SCHEMBL9506054

SCHEMBL9506054

CCCCCCCCC=Cc1ccc(C(=O)N(CC)OC)cc1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.45
CNR1 P21554 4/20 0.38
CNR2 P34972 2/20 0.38
KCNH2 Q12809 1/20 0.38
ABCG2 Q9UNQ0 1/20 0.36

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
SCHEMBL9506051 1.00 TNNC1 (0.45) TNNC1CNR1CNR2KCNH2ABCG2
SCHEMBL9508213 0.89 TNNC1 (0.44) TNNC1CNR1CNR2KCNH2ABCG2
SCHEMBL9508218 0.89 TNNC1 (0.44) TNNC1CNR1CNR2KCNH2ABCG2
SCHEMBL9504802 0.88 TNNC1 (0.44) TNNC1ABCG2
SCHEMBL9508810 0.87 TNNC1 (0.47) TNNC1CNR1CNR2ABCG2
SCHEMBL9508814 0.87 TNNC1 (0.47) TNNC1CNR1CNR2ABCG2
SCHEMBL11020950 0.86 PPARG (0.45) KCNH2
SCHEMBL9504795 0.86 PPARG (0.45) KCNH2
SCHEMBL9508849 0.86 PPARG (0.45) KCNH2
SCHEMBL9508843 0.86 PPARG (0.45) KCNH2

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