SCHEMBL20208622

SCHEMBL20208622

Cc1c(OSC(F)(F)F)ccc2c3c(c(=O)oc12)CN(C(=O)OC(C)(C)C)CC3

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.49
KDM4E B2RXH2 3/20 0.49
HPGD P15428 3/20 0.49
ALDH1A1 P00352 2/20 0.49
TSHR P16473 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
MTHFD1 P11586 4/20 0.47
MTHFD2 P13995 4/20 0.47
RAB9A P51151 2/20 0.47
LMNA P02545 1/20 0.47
GLA P06280 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
GBA1 P04062 1/20 0.44
ERN1 O75460 6/20 0.42
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42

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
SCHEMBL21354096 0.85 MTHFD2 (0.48) HSD17B10KDM4EHPGDALDH1A1TSHR
SCHEMBL20208675 0.84 KDM4E (0.36) HSD17B10KDM4EHPGDALDH1A1TSHR
SCHEMBL20208889 0.84 MTHFD1 (0.47) MTHFD1MTHFD2ERN1FHIT
SCHEMBL20208562 0.83 KDM4E (0.55) HSD17B10KDM4EHPGDALDH1A1TSHR
SCHEMBL30037861 0.79 MTHFD2 (0.62) HSD17B10KDM4EHPGDALDH1A1TSHR
SCHEMBL20208624 0.79 MTHFD2 (0.62) HSD17B10KDM4EHPGDALDH1A1TSHR
SCHEMBL31535516 0.78 ERN1 (0.42) HSD17B10KDM4EHPGDALDH1A1TSHR
SCHEMBL31535335 0.77 ERN1 (0.53) HSD17B10KDM4EHPGDALDH1A1TSHR
SCHEMBL31535216 0.76 ERN1 (0.42) HSD17B10KDM4EHPGDALDH1A1TSHR
SCHEMBL20208671 0.76 MTHFD2 (0.48) HSD17B10KDM4EHPGDALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3546463-B1 SULFONAMIDE DERIVATIVE HAVING COUMARIN SKELETON DAIICHI SANKYO CO LTD (JP) 2022-12-07 EP disclosed
EP-3546463-A1 SULFONAMIDE DERIVATIVE HAVING COUMARIN SKELETON Daiichi Sankyo Co., Ltd. (JP) 2019-10-02 EP disclosed
WO-2018097162-A1 SULFONAMIDE DERIVATIVE HAVING COUMARIN SKELETON 第一三共株式会社 2018-05-31 WO disclosed