SCHEMBL13601396

SCHEMBL13601396

CCOC(=O)CCN1CCC(C)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.54
HTT P42858 1/20 0.54
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 3/20 0.45
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CARM1 Q86X55 1/20 0.42
PRMT6 Q96LA8 1/20 0.42
PRMT1 Q99873 1/20 0.42
PRMT8 Q9NR22 1/20 0.42
TSHR P16473 1/20 0.41
MEN1 O00255 1/20 0.41
CHRM2 P08172 1/20 0.41
HTR1A P08908 1/20 0.41
ADRA2A P08913 1/20 0.41
DRD1 P21728 1/20 0.41
ADRA1A P35348 1/20 0.41

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
SCHEMBL17285917 0.90 KMT2A (0.49) POLBHTTALDH1A1KMT2AL3MBTL1
SCHEMBL13601455 0.87 POLB (0.51) POLBHTTALDH1A1SMN1; SMN2KMT2A
SCHEMBL8714816 0.86 SMN1; SMN2 (0.47) POLBALDH1A1SMN1; SMN2KMT2ALMNA
SCHEMBL29700358 0.85 LMNA (0.49) POLBHTTALDH1A1SMN1; SMN2KMT2A
SCHEMBL8957048 0.85 LMNA (0.49) POLBHTTALDH1A1SMN1; SMN2KMT2A
SCHEMBL674463 0.85 LMNA (0.49) POLBHTTALDH1A1SMN1; SMN2KMT2A
SCHEMBL8714085 0.85 SMN1; SMN2 (0.50) POLBHTTALDH1A1SMN1; SMN2KMT2A
SCHEMBL13601405 0.84 POLB (0.49) POLBHTTALDH1A1KMT2ALMNA
SCHEMBL12881362 0.83 GNAI3 (0.46) POLBALDH1A1SMN1; SMN2KMT2ALMNA
Hydrochloric Acid SCHEMBL8713116 0.83 SMN1; SMN2 (0.49) POLBHTTALDH1A1SMN1; SMN2KMT2A

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962843-B2 1,3,4-oxadiazole and 1,3,4-thiadiazole beta-lactamase inhibitors CUBIST PHARMACEUTICALS, INC. (US) 2015-02-24 US disclosed
US-8962844-B2 1,3,4-oxadiazole and 1,3,4-thiadiazole β-lactamase inhibitors CUBIST PHARMACEUTICALS, INC. (US) 2015-02-24 US disclosed
US-20150031659-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME CORP. 2015-01-29 US disclosed
US-20150031665-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME CORP. 2015-01-29 US disclosed
US-8940897-B2 1,3,4-oxadiazole and 1,3,4-thiadiazole β-lactamase inhibitors CUBIST PHARMACEUTICALS, INC. (US) 2015-01-27 US disclosed
US-8933232-B2 1,3,4-oxadiazole and 1,3,4-thiadiazole beta-lactamase inhibitors CUBIST PHARMACEUTICALS, INC. (US) 2015-01-13 US disclosed
US-8933233-B2 1,3,4-oxadiazole and 1,3,4-thiadiazole β-lactamase inhibitors CUBIST PHARMACEUTICALS, INC. (US) 2015-01-13 US disclosed
US-20140315876-A1 BETA-LACTAMASE INHIBITORS CUBIST PHARMACEUTICALS, INC. 2014-10-23 US disclosed
US-20130303504-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME LLC 2013-11-14 US disclosed
US-20130296293-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME LLC 2013-11-07 US disclosed
US-20130296291-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME LLC 2013-11-07 US disclosed
US-20130296290-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME LLC 2013-11-07 US disclosed
US-20130296292-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME LLC 2013-11-07 US disclosed
US-7625886-B2 Selected CGRP antagonists, processes for preparing them and their use as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-12-01 US disclosed
US-7625886-B2 Selected CGRP antagonists, processes for preparing them and their use as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-12-01 US disclosed
US-20090170749-A1 Novel Compounds Which Interact With PEA-15 INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2009-07-02 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 (9 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-20090170749-A1 Novel Compounds Which Interact With PEA-15 PEBP1, EPS15, PSTPIP2 POLB 4785/4885HTT 4634/4885ALDH1A1 4723/4885
US-20130296293-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS BTD, BLVRB, PEPD POLB 793/4885HTT 4826/4885ALDH1A1 167/4885
US-20150031665-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS BTD, BLVRB, PEPD POLB 793/4885HTT 4826/4885ALDH1A1 167/4885
US-20150031659-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS BTD, BLVRB, BBOX1 POLB 871/4885HTT 4841/4885ALDH1A1 158/4885
US-20130296290-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS BTD, BLVRB, PEPD POLB 793/4885HTT 4826/4885ALDH1A1 167/4885
US-20130303504-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS BTD, BLVRB, PEPD POLB 793/4885HTT 4826/4885ALDH1A1 167/4885
US-20130296291-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS BTD, BLVRB, PEPD POLB 793/4885HTT 4826/4885ALDH1A1 167/4885
US-20140315876-A1 BETA-LACTAMASE INHIBITORS LCT, BCHE, GANAB POLB 452/4885HTT 4702/4885ALDH1A1 842/4885
US-20130296292-A1 1,3,4-OXADIAZOLE AND 1,3,4-THIADIAZOLE BETA-LACTAMASE INHIBITORS BTD, BLVRB, PEPD POLB 793/4885HTT 4826/4885ALDH1A1 167/4885

“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.