SCHEMBL7918876

SCHEMBL7918876

CCOC(=O)COc1c(F)cc(SCCNS(=O)(=O)c2ccccc2)cc1F

nearest known ligand 0.74

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.74
HSD17B10 Q99714 2/20 0.74
CYP2C9 P11712 2/20 0.74
CYP1A2 P05177 1/20 0.74
CYP3A4 P08684 1/20 0.74
NFKB1 P19838 1/20 0.74
PMP22 Q01453 1/20 0.74
HIF1A Q16665 1/20 0.74
GAA P10253 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.45
TSHR P16473 6/20 0.44
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.41
ALOX15 P16050 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PKM P14618 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL7911850 0.92 ALDH1A1 (0.63) ALDH1A1HSD17B10CYP2C9CYP1A2CYP3A4
SCHEMBL18377179 0.91 ALDH1A1 (0.79) ALDH1A1HSD17B10CYP2C9CYP1A2CYP3A4
SCHEMBL7911552 0.90 ALDH1A1 (0.61) ALDH1A1HSD17B10CYP2C9CYP1A2CYP3A4
SCHEMBL7920720 0.89 ALDH1A1 (0.59) ALDH1A1HSD17B10CYP2C9CYP1A2CYP3A4
SCHEMBL7919297 0.87 ALDH1A1 (0.84) ALDH1A1HSD17B10CYP2C9CYP1A2CYP3A4
SCHEMBL13351808 0.87 ALDH1A1 (0.72) ALDH1A1HSD17B10CYP2C9CYP1A2CYP3A4
SCHEMBL21569276 0.87 ALDH1A1 (0.73) ALDH1A1HSD17B10CYP2C9CYP1A2CYP3A4
SCHEMBL7918554 0.87 ALDH1A1 (0.76) ALDH1A1HSD17B10CYP2C9CYP1A2CYP3A4
SCHEMBL20383345 0.86 ALDH1A1 (0.77) ALDH1A1HSD17B10CYP2C9CYP1A2CYP3A4
SCHEMBL18377355 0.86 ALDH1A1 (0.77) ALDH1A1HSD17B10CYP2C9CYP1A2CYP3A4

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
JP-4364158-A None JP disclosed
EP-0811375-B1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA LTD (JP) 2001-01-03 EP disclosed
US-5955505-A TREATING NERVE DEGENERATIVE DISORDERS NIPPON SUISAN KAISHA, LTD. (JP) 1999-09-21 US 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
JP-H04364158-A SULFONAMIDE DERIVATIVE TAISHO PHARMACEUT CO LTD 1992-12-16 JP disclosed
EP-0469901-A1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO. LTD (JP) 1992-02-05 EP disclosed