SCHEMBL1032699

SCHEMBL1032699

Cc1ccc(Cn2cc(C)c(-c3ccc(C)cc3)c2OC(=O)NCc2ccc(F)cc2C(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 6/20 0.42
▸ PPARG P37231 5/20 0.42
▸ P2RX7 Q99572 12/20 0.42
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ KLKB1 P03952 1/20 0.37

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
SCHEMBL1033551 0.85 EPHX2 (0.46) EPHX2PPARGP2RX7KLKB1
SCHEMBL1031357 0.80 P2RX7 (0.46) EPHX2PPARGP2RX7
SCHEMBL1032399 0.80 WDR5 (0.46) EPHX2PPARGKMT2A
SCHEMBL1031826 0.78 PTGER4 (0.43) PPARGP2RX7KMT2AKLKB1
SCHEMBL1029462 0.76 ALDH1A1 (0.46) EPHX2
SCHEMBL4116626 0.76 CNR1 (0.42) MEN1KMT2A
SCHEMBL1028564 0.74 ALDH1A1 (0.38) EPHX2P2RX7MEN1KMT2A
SCHEMBL1031997 0.73 TAAR1 (0.45) EPHX2MEN1KMT2A
SCHEMBL1032390 0.72 P2RX7 (0.42) EPHX2PPARGP2RX7
SCHEMBL1030436 0.72 S1PR1 (0.41) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035375-B1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS GRUENENTHAL GMBH (DE) 2011-01-19 — — EP claimed
EP-2035375-B1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS GRUENENTHAL GMBH (DE) 2011-01-19 — — EP disclosed
EP-2035375-A1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS Grünenthal GmbH (DE) 2009-03-18 — — EP disclosed
WO-2007141039-A1 1,3-DISUBSTITUTED 4-METHYL-1H-PYRROLE-2-CARBOXAMIDES AND THEIR USE FOR THE MANUFACTURE OF MEDICAMENTS Grünenthal GmbH (DE) 2007-12-13 — — WO disclosed
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