SCHEMBL7911932

SCHEMBL7911932

COC(=O)C(F)Oc1ccc(SCCNS(C)(=O)=O)cc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.46
MAPT P10636 2/20 0.46
IDO1 P14902 5/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
NFKB1 P19838 1/20 0.40
PMP22 Q01453 1/20 0.40
HIF1A Q16665 1/20 0.40
TSHR P16473 3/20 0.39
LMNA P02545 3/20 0.39
HTT P42858 2/20 0.39
GPBAR1 Q8TDU6 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
MEP1B Q16820 1/20 0.34

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
SCHEMBL7911904 0.90 ALDH1A1 (0.47) ALDH1A1MAPTIDO1HSD17B10CYP1A2
SCHEMBL7921062 0.87 ALDH1A1 (0.56) ALDH1A1MAPTHSD17B10CYP1A2CYP3A4
SCHEMBL7924116 0.86 ALDH1A1 (0.49) ALDH1A1MAPTHSD17B10CYP1A2CYP3A4
SCHEMBL7924109 0.86 ALDH1A1 (0.47) ALDH1A1MAPTHSD17B10CYP1A2CYP3A4
SCHEMBL7924000 0.84 CNR2 (0.37) ALDH1A1MAPTHSD17B10CYP1A2CYP3A4
SCHEMBL7918967 0.84 ALDH1A1 (0.53) ALDH1A1MAPTIDO1NFKB1TSHR
SCHEMBL7918925 0.83 ALDH1A1 (0.45) ALDH1A1MAPTHSD17B10CYP1A2CYP3A4
SCHEMBL7923989 0.81 ALDH1A1 (0.53) ALDH1A1MAPTHSD17B10CYP1A2CYP3A4
SCHEMBL7918962 0.80 ALDH1A1 (0.48) ALDH1A1MAPTIDO1HSD17B10CYP1A2
SCHEMBL7911820 0.79 ALDH1A1 (0.49) ALDH1A1MAPTHSD17B10CYP1A2CYP3A4

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