SCHEMBL7911248

SCHEMBL7911248

N#Cc1ccc(OCc2cccnc2)cc1F

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.52
CYP11B1 P15538 5/20 0.47
CYP19A1 P11511 3/20 0.47
ALK Q9UM73 1/20 0.46
CYP11B2 P19099 4/20 0.46
MAPK1 P28482 2/20 0.44
MAOA P21397 2/20 0.44
F9 P00740 1/20 0.44
F10 P00742 1/20 0.44
DYRK1A Q13627 1/20 0.44

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
SCHEMBL8119481 0.85 MAOB (0.54) MAOBCYP11B1CYP19A1ALKMAPK1
SCHEMBL8135327 0.83 MAOB (0.54) MAOBCYP11B1CYP11B2MAOA
SCHEMBL427002 0.83 MAOB (0.74) MAOBCYP11B1CYP11B2MAOA
SCHEMBL4424283 0.80 MAOB (0.56) MAOBMAOA
SCHEMBL12260761 0.80 MAPK1 (0.47) MAOBCYP11B1CYP19A1CYP11B2MAPK1
SCHEMBL7673699 0.78 NR1D1 (0.48) CYP11B1CYP19A1CYP11B2MAPK1
SCHEMBL4435816 0.77 MAOB (0.57) MAOBMAOA
SCHEMBL8133729 0.77 CYP19A1 (0.47) MAOBCYP19A1
SCHEMBL29468740 0.77 HSD17B10 (0.49) CYP11B1CYP19A1CYP11B2MAPK1MAOA
SCHEMBL23931747 0.76 GRM5 (0.51) MAOBCYP11B1CYP11B2MAOA

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
US-6211234-B1 BENZONITRILE COMPOUNDS WITH ETHER AND SULFIDE GROUPS WITH CARBOXY ACID RHONE-POULENC RORER LIMITED (GB) 2001-04-03 US disclosed
EP-0728128-B1 SUBSTITUTED PHENYL COMPOUNDS RHONE POULENC RORER LTD (GB) 1998-09-16 EP disclosed
EP-0728128-A1 SUBSTITUTED PHENYL COMPOUNDS RHONE-POULENC RORER LIMITED (GB) 1996-08-28 EP disclosed
WO-1995013262-A1 SUBSTITUTED PHENYL COMPOUNDS RHONE-POULENC RORER LIMITED (GB) 1995-05-18 WO disclosed