SCHEMBL7465795

SCHEMBL7465795

Cc1ccc2c(c1)OC(CCO)C(=O)N2

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.56
GAA P10253 2/20 0.51
USP2 O75604 1/20 0.51
BRD4 O60885 3/20 0.48
TSHR P16473 1/20 0.48
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
HSD17B10 Q99714 2/20 0.46
ALOX15 P16050 2/20 0.46
ALDH1A1 P00352 2/20 0.46

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
SCHEMBL7460746 0.89 L3MBTL1 (0.67) L3MBTL1GAAUSP2TSHRMEN1
SCHEMBL19423620 0.84 USP2 (0.51) GAAUSP2BRD4TSHRMEN1
SCHEMBL3598938 0.83 L3MBTL1 (0.53) L3MBTL1GAAUSP2BRD4MEN1
SCHEMBL7466727 0.83 L3MBTL1 (0.53) L3MBTL1GAAUSP2BRD4MEN1
SCHEMBL328091 0.82 USP2 (0.50) GAAUSP2BRD4TSHRMEN1
SCHEMBL7460760 0.82 L3MBTL1 (0.53) L3MBTL1GAAUSP2BRD4MEN1
SCHEMBL7476036 0.80 ALDH1A1 (0.67) L3MBTL1GAABRD4MEN1KMT2A
SCHEMBL5670577 0.79 L3MBTL1 (0.58) L3MBTL1GAAUSP2TSHRMEN1
SCHEMBL7468823 0.78 BRD4 (0.45) GAAUSP2BRD4TSHRMEN1
SCHEMBL279853 0.78 USP2 (0.46) L3MBTL1GAAUSP2BRD4TSHR

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