SCHEMBL17036734

SCHEMBL17036734

CC(C)(C)OCCS(=O)(=O)N1CCCC1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.34
TSHR P16473 4/20 0.33
HPGD P15428 1/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
POLB P06746 1/20 0.32
GAA P10253 2/20 0.32
NPBWR1 P48145 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 2/20 0.31
MAPK1 P28482 1/20 0.31
RECQL P46063 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL17036719 0.98 TSHR (0.36) ALDH1A1TSHRHPGDCA1CA2
SCHEMBL17036749 0.85 L3MBTL1 (0.38) ALDH1A1TSHRPOLBKMT2AMAPK1
SCHEMBL17036741 0.84 ALDH1A1 (0.51) ALDH1A1TSHRLMNAKMT2AL3MBTL1
SCHEMBL12452723 0.81 TSHR (0.33) ALDH1A1TSHRHPGDCA1CA2
SCHEMBL17039437 0.78 MAPT (0.42) ALDH1A1TSHRHPGDLMNA
SCHEMBL17039355 0.76 TSHR (0.43) ALDH1A1TSHRHPGDCA1CA2
SCHEMBL17039349 0.74 ALDH1A1 (0.44) ALDH1A1TSHRHPGDCA1CA2
SCHEMBL18572507 0.74 TSHR (0.33) ALDH1A1TSHRHPGDCA1CA2
SCHEMBL19804012 0.73 ALDH1A1 (0.44) ALDH1A1TSHRHPGDCA1CA2
SCHEMBL17052450 0.71 CNR1 (0.38) ALDH1A1HPGDGAALMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-03-09 US disclosed
US-10550140-B2 Ether compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2020-02-04 US disclosed
US-20190048033-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2019-02-14 US disclosed
US-20180022766-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2018-01-25 US disclosed
US-9732104-B2 Ether compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
US-9732104-B2 Ether compounds for treatment of complement mediated disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-08-15 US disclosed
US-20160362433-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS ACHILLION PHARMACEUTICALS, INC. (US) 2016-12-15 US disclosed
US-20150239920-A1 Ether Compounds for Treatment of Complement Mediated Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2015-08-27 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 (6 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-10550140-B2 Ether compounds for treatment of complement mediated disorders TFPI, CFD, C9 ALDH1A1 2728/4885TSHR 1591/4885HPGD 3029/4885
US-20160362433-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS CFD, C9, TFPI ALDH1A1 3312/4885TSHR 1898/4885HPGD 2054/4885
US-20230071620-A1 PHARMACEUTICAL COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, TFPI, CFH ALDH1A1 3105/4885TSHR 3263/4885HPGD 92/4885
US-20190048033-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS TFPI, CFD, C9 ALDH1A1 2728/4885TSHR 1591/4885HPGD 3029/4885
US-20180022766-A1 ETHER COMPOUNDS FOR TREATMENT OF COMPLEMENT MEDIATED DISORDERS TFPI, CFD, C9 ALDH1A1 2728/4885TSHR 1591/4885HPGD 3029/4885
US-20150239920-A1 Ether Compounds for Treatment of Complement Mediated Disorders TFPI, CFD, C9 ALDH1A1 2728/4885TSHR 1591/4885HPGD 3029/4885

“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.