SCHEMBL7924028

SCHEMBL7924028

Cc1ccc(S(=O)(=O)NCCSc2ccc(OC(F)C(=O)O)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 13/20 0.62
TSHR P16473 4/20 0.62
LMNA P02545 2/20 0.54
HTT P42858 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.50
GAA P10253 2/20 0.49
MAPT P10636 3/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
HSD17B10 Q99714 1/20 0.44
POLB P06746 1/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL7920706 0.91 ALDH1A1 (0.53) ALDH1A1TSHRLMNAHTTGAA
SCHEMBL7924095 0.90 ALDH1A1 (0.62) ALDH1A1TSHRLMNAHTTGAA
SCHEMBL7920847 0.90 ALDH1A1 (0.56) ALDH1A1TSHRL3MBTL1GAAMAPT
SCHEMBL7918672 0.89 ALDH1A1 (0.50) ALDH1A1TSHRLMNAHTTL3MBTL1
SCHEMBL7911840 0.89 ALDH1A1 (0.62) ALDH1A1TSHRLMNAHTTGAA
SCHEMBL7918975 0.86 ALDH1A1 (0.47) ALDH1A1TSHRLMNAGAAMAPT
SCHEMBL7920946 0.85 ALDH1A1 (0.57) ALDH1A1TSHRLMNAHTTL3MBTL1
SCHEMBL7924132 0.84 ALDH1A1 (0.55) ALDH1A1TSHRLMNAHTTGAA
SCHEMBL7918943 0.83 ALDH1A1 (0.52) ALDH1A1TSHRLMNAHTTGAA
SCHEMBL7911874 0.83 ALDH1A1 (0.62) ALDH1A1TSHRLMNAHTTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0811375-B1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA LTD (JP) 2001-01-03 EP disclosed
EP-0811375-A1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA, LTD. (JP) 1997-12-10 EP disclosed
EP-0469901-B1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 1994-10-19 EP disclosed
US-5189211-A Thromboxane A2 antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 1993-02-23 US disclosed
EP-0469901-A1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO. LTD (JP) 1992-02-05 EP disclosed