SCHEMBL7177458

SCHEMBL7177458

O=C(NO)C(O)C(Nc1ccc(Oc2ccccc2)cc1)C(=O)NC(Cc1ccccc1)C(=O)N1CCOCC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.52
TACR2 P21452 14/20 0.49
CTSS P25774 1/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
HTT P42858 1/20 0.45
FPR2 P25090 2/20 0.43
MMP1 P03956 1/20 0.43
MMP3 P08254 1/20 0.43

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
SCHEMBL7185090 0.91 MMP8 (0.55) MMP8TACR2CTSSALDH1A1FPR2
SCHEMBL7174696 0.89 MMP8 (0.48) MMP8TACR2CTSSKDM4EALDH1A1
SCHEMBL7172621 0.87 MMP8 (0.46) MMP8TACR2CTSSKDM4EALDH1A1
SCHEMBL7306891 0.83 ALDH1A1 (0.43) MMP8TACR2CTSSKDM4EALDH1A1
SCHEMBL7170101 0.82 FCER2 (0.56) MMP8MMP1MMP3
SCHEMBL7173680 0.81 ALDH1A1 (0.41) MMP8TACR2CTSSKDM4EALDH1A1
SCHEMBL7173324 0.76 SCN9A (0.43) MMP8ALDH1A1MMP1MMP3
SCHEMBL7174231 0.75 MMP8 (0.45) MMP8KDM4EMMP1
SCHEMBL1825413 0.73 MMP8 (0.71) MMP8CTSSALDH1A1MMP1MMP3
SCHEMBL7173722 0.72 FCER2 (0.57) MMP8MMP1MMP3

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
US-6576628-B1 Matrix metalloprotease inhibitors; arthritis, corneal ulcers, arteriosclerosis ROCHE DIAGNOSTICS GMBH (DE) 2003-06-10 US disclosed
EP-1005449-B1 3-ARYL-SUCCINAMIDO-HYDROXAMIC ACIDS, METHODS FOR PRODUCING SAID ACIDS AND MEDICAMENTS CONTAINING THE SAME ROCHE DIAGNOSTICS GMBH (DE) 2002-10-30 EP disclosed
EP-1005449-A1 3-ARYL-SUCCINAMIDO-HYDROXAMIC ACIDS, METHODS FOR PRODUCING SAID ACIDS AND MEDICAMENTS CONTAINING THE SAME Roche Diagnostics GmbH (DE) 2000-06-07 EP disclosed
WO-1999009003-A1 3-ARYL-SUCCINAMIDO-HYDROXAMIC ACIDS, METHODS FOR PRODUCING SAID ACIDS AND MEDICAMENTS CONTAINING THE SAME ROCHE DIAGNOSTICS GMBH (DE) 1999-02-25 WO disclosed
EP-0897908-A1 3-Aryl-succinamido-hydroxamic acids, process for their preparation and medicaments containing them Roche Diagnostics GmbH (DE) 1999-02-24 EP disclosed