SCHEMBL8667461

SCHEMBL8667461

c1ccc(CCCC2CCCN2)cc1

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
LTA4H P09960 2/20 0.50
KMT2A Q03164 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
SCHEMBL11539185 0.95 POLB (0.65) POLBLTA4HKMT2A
SCHEMBL6535590 0.89 POLB (0.61) POLBLTA4H
SCHEMBL2693506 0.89 POLB (0.61) POLBLTA4H
SCHEMBL6535532 0.89 POLB (0.61) POLBLTA4H
SCHEMBL10601127 0.89 POLB (0.61) POLBLTA4HKMT2A
SCHEMBL478125 0.84 POLB (0.69) POLBLTA4HKMT2A
SCHEMBL20056786 0.82 POLB (0.53) POLBLTA4H
SCHEMBL29139845 0.81 SIGMAR1 (0.47)
SCHEMBL9015256 0.79 POLB (0.57) POLBLTA4H
SCHEMBL7404503 0.79 SIGMAR1 (0.54) POLBKMT2A

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-0876347-A1 QUINOLINE DERIVATIVES Smithkline Beecham S.p.A. (IT) 1998-11-11 EP disclosed
WO-1997021680-A1 QUINOLINE DERIVATIVES SMITHKLINE BEECHAM S.P.A. (IT) 1997-06-19 WO disclosed