SCHEMBL8308720

SCHEMBL8308720

Nc1ccc(OCc2ccccn2)c(F)c1F

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 16/20 0.51
AURKB Q96GD4 4/20 0.46
INCENP Q9NQS7 4/20 0.46
ABCB1 P08183 1/20 0.46
HTR1A P08908 1/20 0.46
DRD2 P14416 1/20 0.46
FFAR1 O14842 1/20 0.44
PARP10 Q53GL7 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL27096930 0.87 SYK (0.55) SYKAURKBINCENPABCB1HTR1A
SCHEMBL8308612 0.87 SYK (0.49) SYKAURKBINCENPABCB1HTR1A
SCHEMBL30729929 0.87 SYK (0.55) SYKAURKBINCENPABCB1HTR1A
SCHEMBL27096901 0.87 SYK (0.51) SYKAURKBINCENPABCB1HTR1A
SCHEMBL9719784 0.78 SYK (0.58) SYKAURKBINCENPABCB1HTR1A
SCHEMBL9719880 0.78 SYK (0.58) SYKAURKBINCENPABCB1HTR1A
SCHEMBL8308610 0.78 ALOX5AP (0.42) SYKAURKBINCENPFFAR1PARP10
SCHEMBL6068690 0.77 SYK (0.65) SYKAURKBINCENPABCB1HTR1A
SCHEMBL29963339 0.77 SYK (0.65) SYKAURKBINCENPABCB1HTR1A
SCHEMBL8306570 0.77 SYK (0.54) SYKAURKBINCENPABCB1HTR1A

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-0790986-B1 ANILINE DERIVATIVES ZENECA LTD (GB) 1999-01-20 EP disclosed
US-5821246-A USEFUL AS TYROSINE KINASE INHIBITORS AND FOR THE TREATMENT OF PROLIFERATIVE DISEASES SUCH AS CANCER ZENECA LIMITED (GB) 1998-10-13 US disclosed
EP-0790986-A1 ANILINE DERIVATIVES ZENECA LIMITED (GB) 1997-08-27 EP disclosed
WO-1996015118-A1 ANILINE DERIVATIVES ZENECA LIMITED (GB) 1996-05-23 WO disclosed