SCHEMBL3720198

SCHEMBL3720198

CCOc1ccc(COc2ccc3cc(CCN)ccc3c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.54
ALOX5 P09917 1/20 0.46

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
SCHEMBL3726846 0.86 LTA4H (0.47)
SCHEMBL1027713 0.80 TAAR1 (0.63) MAOB
SCHEMBL3722774 0.79 RAB9A (0.49) MAOBALOX5
SCHEMBL15345375 0.79 NQO1 (0.48)
SCHEMBL11282999 0.78 TSHR (0.47) MAOB
SCHEMBL3720835 0.76 ACACB (0.64)
SCHEMBL15345584 0.76 AGXT (0.47)
SCHEMBL3716715 0.75 TAAR1 (0.68) MAOB
SCHEMBL3720195 0.75 POLB (0.47) ALOX5
SCHEMBL3723856 0.75 LTA4H (0.49)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010127208-A1 INHIBITORS OF ACETYL-COA CARBOXYLASE FOREST LABORATORIES HOLDINGS LIMITED (BM) 2010-11-04 WO disclosed