SCHEMBL7451241

SCHEMBL7451241

O=C1c2ccccc2C(=O)N1CCCOc1ccc(Cc2ccccc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.77
MAPT P10636 2/20 0.77
SMN1; SMN2 Q16637 1/20 0.77
HPGD P15428 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
NPC1 O15118 1/20 0.58
HRH3 Q9Y5N1 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
LTA4H P09960 3/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50

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
SCHEMBL5632907 0.88 RAB9A (0.77) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL7299163 0.88 RAB9A (1.00) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL10674350 0.85 RAB9A (0.82) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL8298007 0.83 RAB9A (0.79) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL15031615 0.83 RAB9A (0.68) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL1999435 0.83 RAB9A (0.90) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL3626811 0.82 RAB9A (0.72) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL24658769 0.82 RAB9A (0.77) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL5631833 0.82 RAB9A (0.77) RAB9AMAPTSMN1; SMN2HPGDNPSR1
SCHEMBL10050510 0.82 RAB9A (0.85) RAB9AMAPTSMN1; SMN2HPGDNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0724578-A1 AMINE DERIVATIVES AS CALCIUM CHANNEL ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1996-08-07 EP disclosed
WO-1995011240-A1 AMINE DERIVATIVES AS CALCIUM CHANNEL ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 1995-04-27 WO disclosed