SCHEMBL16075552

SCHEMBL16075552

CC(=O)OCC(C)(C)N1CCOCC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
TSHR P16473 3/20 0.41
SMN1; SMN2 Q16637 5/20 0.40
USP2 O75604 1/20 0.40
ALDH1A1 P00352 3/20 0.39
POLB P06746 3/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RECQL P46063 1/20 0.38
LMNA P02545 3/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPK1 P28482 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17486664 0.84 MAPT (0.40) MAPTTSHRSMN1; SMN2USP2ALDH1A1
SCHEMBL16119715 0.83 TSHR (0.42) MAPTTSHRSMN1; SMN2USP2ALDH1A1
SCHEMBL20392801 0.83 L3MBTL1 (0.41) MAPTTSHRSMN1; SMN2USP2ALDH1A1
SCHEMBL28024347 0.80 SMN1; SMN2 (0.45) MAPTTSHRSMN1; SMN2USP2ALDH1A1
SCHEMBL18475748 0.78 HCAR2 (0.38) MAPTTSHRSMN1; SMN2USP2ALDH1A1
SCHEMBL8214792 0.77 ALDH1A1 (0.36) MAPTTSHRSMN1; SMN2USP2ALDH1A1
SCHEMBL18775073 0.75 ALDH1A1 (0.36) MAPTSMN1; SMN2USP2ALDH1A1POLB
SCHEMBL18872255 0.73 SMN1; SMN2 (0.36) MAPTSMN1; SMN2USP2ALDH1A1POLB
Tetrahydrofuran SCHEMBL28565880 0.72 ALDH1A1 (0.34) TSHRSMN1; SMN2USP2ALDH1A1POLB
SCHEMBL16254565 0.71 POLB (0.53) MAPTALDH1A1POLBL3MBTL1RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170355713-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN BIOPHARMA CREDIT PLC (GB) 2017-12-14 US disclosed
US-9802900-B2 Bicyclic heteroaryl compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. (US) 2017-10-31 US disclosed
US-9776960-B2 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. (US) 2017-10-03 US disclosed
US-20170174654-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. 2017-06-22 US disclosed
US-9604999-B2 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. (US) 2017-03-28 US disclosed
US-20160332984-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. 2016-11-17 US disclosed
US-9458139-B2 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. (US) 2016-10-04 US disclosed
US-9422279-B2 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. (US) 2016-08-23 US disclosed
US-20160152602-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. (US) 2016-06-02 US disclosed
US-20160083348-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. (US) 2016-03-24 US disclosed
US-20160031904-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. (US) 2016-02-04 US disclosed
US-20160031865-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. (US) 2016-02-04 US disclosed
US-20150259296-A1 BICYCLIC HETEROARYL COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. 2015-09-17 US disclosed
US-20150141465-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. 2015-05-21 US disclosed
US-20150133430-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN GLOBAL BLOOD THERAPEUTICS, INC. 2015-05-14 US disclosed
US-8952171-B2 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. (US) 2015-02-10 US disclosed
US-20140275008-A1 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. 2014-09-18 US disclosed
US-20140275176-A1 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. 2014-09-18 US disclosed
US-20140275181-A1 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. 2014-09-18 US disclosed
US-20140275152-A1 Compounds and uses thereof for the modulation of hemoglobin GLOBAL BLOOD THERAPEUTICS, INC. 2014-09-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (14 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170174654-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20140275181-A1 Compounds and uses thereof for the modulation of hemoglobin HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20160031904-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20150141465-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20140275176-A1 Compounds and uses thereof for the modulation of hemoglobin HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20160332984-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20170355713-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20160083348-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20160152602-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20160031865-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20150133430-A1 COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20150259296-A1 BICYCLIC HETEROARYL COMPOUNDS AND USES THEREOF FOR THE MODULATION OF HEMOGLOBIN HBG2, HBB, HBG1 MAPT 4667/4885TSHR 3087/4885SMN1; SMN2 1212/4885
US-20140275152-A1 Compounds and uses thereof for the modulation of hemoglobin HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885
US-20140275008-A1 Compounds and uses thereof for the modulation of hemoglobin HBG2, HBG1, HBB MAPT 4181/4885TSHR 3518/4885SMN1; SMN2 1176/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.