SCHEMBL14977488

SCHEMBL14977488

NC(=O)c1cnc(NCCCN(C(=O)O)C2CC2)nc1Nc1cccc(-c2ncccn2)c1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 20/20 0.58
▸ ZAP70 P43403 4/20 0.50
▸ KCNH2 Q12809 1/20 0.50
▸ AURKB Q96GD4 1/20 0.50
▸ CAMK1D Q8IU85 1/20 0.50
▸ PRKCE Q02156 1/20 0.49
▸ BTK Q06187 1/20 0.49
▸ ITK Q08881 1/20 0.49

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) SYKZAP70KCNH2AURKB
SCHEMBL16100226 0.81 SYK (0.66) SYKZAP70KCNH2AURKB
SCHEMBL14977487 0.78 SYK (0.67) SYK
SCHEMBL14977815 0.77 STAT6 (0.59) SYKZAP70KCNH2AURKB
SCHEMBL14977422 0.77 SYK (0.62) SYK
SCHEMBL1354438 0.76 SYK (0.73) SYK
SCHEMBL1354443 0.76 SYK (0.73) SYK
SCHEMBL14976632 0.75 SYK (0.76) SYKKCNH2AURKB
SCHEMBL14976634 0.75 SYK (0.76) SYKKCNH2AURKB
SCHEMBL1351796 0.74 SYK (1.00) SYK

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-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
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