SCHEMBL27347251

SCHEMBL27347251

CCCCCCCC/C=C\CCCCCCCC(=O)N(C)C(C)(C)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 2/20 0.57
▸ PPARG P37231 4/20 0.56
▸ PPARD Q03181 4/20 0.56
▸ PPARA Q07869 4/20 0.56
▸ F7 P08709 4/20 0.56
▸ F3 P13726 4/20 0.56
▸ TERT O14746 3/20 0.56
▸ PTPN1 P18031 3/20 0.56
▸ HSD17B10 Q99714 3/20 0.56
▸ FABP4 P15090 3/20 0.56
▸ MAPT P10636 2/20 0.56
▸ BLM P54132 2/20 0.56
▸ CYP1A2 P05177 2/20 0.56
▸ CYP2C19 P33261 2/20 0.56
▸ FAAH O00519 2/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ LMNA P02545 2/20 0.56
▸ ALOX15 P16050 2/20 0.56
▸ DUSP3 P51452 2/20 0.56
▸ CYP19A1 P11511 2/20 0.56

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
SCHEMBL28766940 0.91 GPR84 (0.47) PPARGPPARDPPARAPTPN1HSD17B10
SCHEMBL27899376 0.89 GPR84 (0.45) PPARGPPARDPPARAPTPN1HSD17B10
SCHEMBL16465358 0.82 EPHX2 (0.58) EPHX2PPARGPPARDPPARAF7
SCHEMBL28653654 0.81 FAAH (0.54) EPHX2PPARGPPARDPPARAF7
SCHEMBL8004893 0.79 EPHX2 (0.64) EPHX2PPARGPPARDPPARAF7
SCHEMBL8736540 0.79 EPHX2 (0.64) EPHX2PPARGPPARDPPARAF7
SCHEMBL540326 0.79 EPHX2 (0.64) EPHX2PPARGPPARDPPARAF7
SCHEMBL8925859 0.79 EPHX2 (0.64) EPHX2PPARGPPARDPPARAF7
SCHEMBL5032813 0.79 EPHX2 (0.64) EPHX2PPARGPPARDPPARAF7
SCHEMBL18209381 0.79 EPHX2 (0.64) EPHX2PPARGPPARDPPARAF7

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
CN-103204852-A Heteroaryl amide analogues as P2X7 antagonists LUNDBECK & CO AS H 2013-07-17 — — CN disclosed
CN-101772498-A As P2X7Heteroaryl amide analogs of antagonists LUNDBECK & CO AS H 2010-07-07 — — CN disclosed
CN-1059158-A Finishing method and composition REM CHEMICALS INC (US) 1992-03-04 — — CN disclosed
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