SCHEMBL7475258

SCHEMBL7475258

COc1ccc2c(c1)NC(=O)C(CC(O[SiH](C)C)C(C)(C)C)O2

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.44
KMT2A Q03164 4/20 0.42
MEN1 O00255 2/20 0.42
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
MAPK1 P28482 1/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TSHR P16473 1/20 0.35

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
SCHEMBL7478473 0.92 KMT2A (0.42) HSD17B10KMT2AMEN1USP2GAA
SCHEMBL7470594 0.87 USP2 (0.53) HSD17B10KMT2AMEN1USP2GAA
SCHEMBL8601457 0.86 USP2 (0.39) HSD17B10KMT2AMEN1USP2GAA
SCHEMBL7463472 0.86 HSD17B10 (0.48) HSD17B10KMT2AMEN1USP2GAA
SCHEMBL7464320 0.84 USP2 (0.38) HSD17B10KMT2AMEN1USP2GAA
SCHEMBL7476310 0.84 USP2 (0.45) HSD17B10KMT2AMEN1USP2GAA
SCHEMBL7473281 0.83 MEN1 (0.38) HSD17B10KMT2AMEN1USP2GAA
SCHEMBL7472425 0.83 PARP1 (0.45) HSD17B10KMT2AMEN1USP2GAA
SCHEMBL7472196 0.82 KMT2A (0.44) HSD17B10KMT2AMEN1USP2GAA
SCHEMBL7468831 0.81 USP2 (0.42) HSD17B10KMT2AMEN1USP2GAA

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-0869949-B1 BENZOXAZINE ANTIMICROBIAL AGENTS ORTHO MCNEIL PHARM INC (US) 2002-12-18 EP disclosed
US-5854242-A Benzoxazine antimicrobial agents ORTHO PHARMACEUTICAL CORPORATION (US) 1998-12-29 US disclosed
EP-0869949-A1 BENZOXAZINE ANTIMICROBIAL AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1998-10-14 EP disclosed
US-5696117-A BACTERICIDE ORTHO PHARMACEUTICAL CORPORATION (US) 1997-12-09 US disclosed
WO-1997017333-A1 BENZOXAZINE ANTIMICROBIAL AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1997-05-15 WO disclosed