SCHEMBL8625403

SCHEMBL8625403

Cc1ccc([AsH2])cc1OCc1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 16/20 0.51
AURKB Q96GD4 4/20 0.51
INCENP Q9NQS7 4/20 0.51
ABCB1 P08183 2/20 0.44
HTR1A P08908 2/20 0.44
DRD2 P14416 2/20 0.44
EGFR P00533 1/20 0.42
ERBB2 P04626 1/20 0.42

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
SCHEMBL8625407 0.88 SYK (0.55) SYKAURKBINCENPABCB1HTR1A
SCHEMBL6190711 0.82 SYK (0.69) SYKAURKBINCENPABCB1HTR1A
SCHEMBL12301166 0.80 SYK (0.62) SYKAURKBINCENPABCB1HTR1A
SCHEMBL6187792 0.76 ALDH1A1 (0.54) SYK
SCHEMBL2760114 0.75 SYK (0.61) SYKAURKBINCENPEGFRERBB2
SCHEMBL2250667 0.74 SYK (0.52) SYKAURKBINCENPABCB1HTR1A
SCHEMBL1406446 0.73 SYK (0.65) SYKAURKBINCENPABCB1HTR1A
SCHEMBL21835286 0.72 SYK (0.50) SYKAURKBINCENPABCB1HTR1A
SCHEMBL15701533 0.72 MRGPRX4 (0.52) SYKAURKBINCENPEGFRERBB2
SCHEMBL26580976 0.71 KDM4E (0.51) SYKAURKBINCENP

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-0880507-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ZENECA LIMITED (GB) 1998-12-02 EP disclosed
EP-0790986-A1 ANILINE DERIVATIVES ZENECA LIMITED (GB) 1997-08-27 EP disclosed
WO-1997030034-A1 QUINAZOLINE DERIVATIVES AS ANTITUMOR AGENTS ZENECA LIMITED (GB) 1997-08-21 WO disclosed
WO-1996015118-A1 ANILINE DERIVATIVES ZENECA LIMITED (GB) 1996-05-23 WO disclosed