SCHEMBL9504759

SCHEMBL9504759

CCCCCCCCC=Cc1ccc(C(=O)N(C)OCc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CETP P11597 3/20 0.43
TNNC1 P63316 1/20 0.43
EPHX2 P34913 4/20 0.42
FAAH O00519 2/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
PPARA Q07869 1/20 0.39
LPAR1 Q92633 1/20 0.39
SOAT2 O75908 1/20 0.39
SOAT1 P35610 1/20 0.39

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
SCHEMBL9504755 1.00 CETP (0.43) CETPTNNC1EPHX2FAAHCNR1
SCHEMBL9504718 0.83 OXER1 (0.41) EPHX2FAAHPPARA
SCHEMBL9504708 0.83 OXER1 (0.41) EPHX2FAAHPPARA
SCHEMBL9508814 0.83 TNNC1 (0.47) TNNC1CNR1CNR2
SCHEMBL9508810 0.83 TNNC1 (0.47) TNNC1CNR1CNR2
SCHEMBL27671412 0.83 ALOX5 (0.42) TNNC1EPHX2FAAHCNR1CNR2
SCHEMBL9506831 0.83 EPHX2 (0.42) EPHX2FAAHPPARA
SCHEMBL9508184 0.83 TNNC1 (0.41) CETPTNNC1EPHX2FAAHCNR1
SCHEMBL9506810 0.83 EPHX2 (0.42) EPHX2FAAHPPARA
SCHEMBL28766291 0.82 EPHX2 (0.40) EPHX2FAAHCNR1CNR2THRA

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-0161939-B1 ARYLHYDROXAMATES E.R. Squibb & Sons, Inc. (US) 1993-07-21 EP disclosed
CN-85104470-A The method for preparing arythydroxamtes 1986-10-01 CN disclosed
US-4607053-A L2POXYGENASE INHIBITORS E. R. SQUIBB & SONS, INC. (US) 1986-08-19 US disclosed
EP-0161939-A2 Arylhydroxamates E.R. Squibb & Sons, Inc. (US) 1985-11-21 EP disclosed