SCHEMBL14977815

SCHEMBL14977815

Cc1cccc(Nc2nc(NCCCN(C(=O)OCc3ccccc3)C3CC3)ncc2C(N)=O)c1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ STAT6 P42226 7/20 0.59
▸ SYK P43405 13/20 0.58
▸ KCNH2 Q12809 4/20 0.58
▸ AURKB Q96GD4 2/20 0.58
▸ ZAP70 P43403 1/20 0.58
▸ MAPK3 P27361 1/20 0.53
▸ MAPK1 P28482 1/20 0.53

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
SCHEMBL14977695 0.88 SYK (0.67) STAT6SYKKCNH2AURKBZAP70
SCHEMBL14977864 0.81 SYK (0.56) STAT6SYKKCNH2AURKBZAP70
SCHEMBL12137100 0.78 SYK (0.79) STAT6SYKKCNH2AURKBZAP70
SCHEMBL14977488 0.77 SYK (0.58) SYKKCNH2AURKBZAP70
SCHEMBL1354433 0.76 SYK (0.86) STAT6SYKKCNH2AURKBZAP70
SCHEMBL29794716 0.75 SYK (1.00) STAT6SYKKCNH2AURKBZAP70
SCHEMBL2383949 0.75 SYK (1.00) STAT6SYKKCNH2AURKBZAP70
SCHEMBL14975932 0.74 SYK (0.72) STAT6SYKKCNH2AURKBZAP70
SCHEMBL2714185 0.74 SYK (0.48) STAT6SYKKCNH2AURKBZAP70
SCHEMBL4713176 0.73 SYK (0.81) STAT6SYKKCNH2AURKBZAP70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2782580-A1 SELECTIVE KINASE INHIBITORS Portola Pharmaceuticals, Inc. (US) 2014-10-01 — — EP disclosed
WO-2013078468-A1 SELECTIVE KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 — — WO disclosed
WO-2013078086-A1 PHOTOCHROMIC COMPOUNDS HAVING AT LEAST TWO PHOTOCHROMIC MOIETIES TRANSITIONS OPTICAL, INC. (US) 2013-05-30 — — WO disclosed
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