SCHEMBL3645245

SCHEMBL3645245

FC(F)(F)c1cccc(C[C@@H]2CCCCN2)c1

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.60
DRD2 P14416 1/20 0.52
DRD3 P35462 1/20 0.52
LTA4H P09960 1/20 0.47
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
HTR6 P50406 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43

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
SCHEMBL3347781 1.00 POLB (0.60) POLBDRD2DRD3LTA4HKDM4E
SCHEMBL10132521 0.96 POLB (0.54) POLBDRD2DRD3KDM4EALDH1A1
SCHEMBL8212935 0.85 POLB (0.54) POLBDRD2DRD3LTA4HGAA
SCHEMBL8269038 0.82 POLB (0.63) POLBDRD2DRD3LTA4HHTR6
SCHEMBL6977910 0.81 ALDH1A1 (0.43) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL3681565 0.79 POLB (0.68) POLBLTA4HHTR6
SCHEMBL14940526 0.79 POLB (0.68) POLBLTA4HHTR6
SCHEMBL6972577 0.79 KDM4E (0.41) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL6980008 0.79 ALOX5 (0.42) DRD2DRD3KDM4EALDH1A1GAA
SCHEMBL3366280 0.79 KDM4E (0.51) KDM4EALDH1A1GAAMEN1KMT2A

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-2170865-A2 NOVEL SUBSTITUTED INDAZOLES, THE PREPARATION THEREOF, AND USE OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2010-04-07 EP claimed
WO-2009010660-A2 SUBSTITUTED INDAZOLES, THE PREPARATION THEREOF, AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2009-01-22 WO claimed
EP-2170865-A2 NOVEL SUBSTITUTED INDAZOLES, THE PREPARATION THEREOF, AND USE OF SAME IN THERAPEUTICS Sanofi-Aventis (FR) 2010-04-07 EP disclosed
WO-2009010660-A2 SUBSTITUTED INDAZOLES, THE PREPARATION THEREOF, AND USE OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2009-01-22 WO disclosed