SCHEMBL5149443

SCHEMBL5149443

NC1(F)C=CC=CC1c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.39
HTR2C P28335 2/20 0.39
HTR2B P41595 2/20 0.39
MAOB P27338 17/20 0.34
MAOA P21397 16/20 0.34
KDM1A O60341 14/20 0.34

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
SCHEMBL734440 0.82 KDM1A (0.38) HTR2AHTR2CHTR2BMAOBMAOA
SCHEMBL3789285 0.81 DDB1 (0.37) MAOBMAOA
SCHEMBL1153469 0.78 KDM1A (0.44) HTR2AHTR2CHTR2BMAOBMAOA
SCHEMBL20017698 0.77 HTR2A (0.35) HTR2AHTR2CHTR2BMAOBMAOA
SCHEMBL9100196 0.77 KDM1A (0.34) HTR2AHTR2CHTR2BMAOBMAOA
SCHEMBL2870312 0.76 MAOA (0.39) HTR2AHTR2CHTR2BMAOBMAOA
SCHEMBL20839329 0.73 MAOA (0.32) MAOBMAOAKDM1A
SCHEMBL16599817 0.73 HTR2A (0.33) HTR2AHTR2CHTR2B
SCHEMBL31716197 0.73 CUL4A (0.35) MAOBMAOAKDM1A
SCHEMBL5458200 0.72

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
EP-1856024-A1 METHOD FOR PRODUCING SUBSTITUTED BIPHENYLS BASF AKTIENGESELLSCHAFT (DE) 2007-11-21 EP disclosed
WO-2006092429-A1 METHOD FOR PRODUCING SUBSTITUTED BIPHENYLS BASF AKTIENGESELLSCAHFT (DE) 2006-09-08 WO disclosed
EP-0536151-A1 ORTHOSUBSTITUTED BIPHENYL GUANIDINE DERIVATIVES AND ANTIDIABETIC OR HYPOGLYCAEMIC AGENTS CONTAINING THEM. BOOTS CO PLC (GB) 1993-04-14 EP disclosed