SCHEMBL9713817

SCHEMBL9713817

CCCCCCCOc1ccc(C(=O)Nc2ccccc2OCc2nnn[nH]2)cc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 4/20 0.59
CYSLTR2 Q9NS75 10/20 0.49
CYSLTR1 Q9Y271 10/20 0.49
GAA P10253 1/20 0.47
CACNA1H O95180 1/20 0.47
CACNA1B Q00975 1/20 0.47

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
SCHEMBL9857433 0.90 SMPD1 (0.52) PLK1CYSLTR2CYSLTR1
SCHEMBL9132741 0.90 PLK1 (0.52) PLK1CYSLTR2CYSLTR1CACNA1HCACNA1B
SCHEMBL9132501 0.90 PLK1 (0.52) PLK1CYSLTR2CYSLTR1CACNA1HCACNA1B
SCHEMBL9257603 0.88 CYSLTR1 (0.51) PLK1CYSLTR2CYSLTR1CACNA1HCACNA1B
SCHEMBL9254823 0.88 CYSLTR2 (0.52) PLK1CYSLTR2CYSLTR1GAACACNA1H
SCHEMBL9254816 0.87 PLK1 (0.44) PLK1CYSLTR2CYSLTR1GAA
SCHEMBL9255356 0.87 PLK1 (0.44) PLK1CYSLTR2CYSLTR1GAA
SCHEMBL9133034 0.87 PLK1 (0.52) PLK1CYSLTR2CYSLTR1CACNA1HCACNA1B
SCHEMBL10721101 0.84 NR1H4 (0.59) PLK1CYSLTR2CYSLTR1
SCHEMBL9135604 0.84 CACNA1H (0.49) PLK1CYSLTR2CYSLTR1CACNA1HCACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4994479-A Antagonists of SRS-A(slow reacting substance of anaphylaxis); antiallergens, antiischemic agents YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-02-19 US claimed
EP-0218728-A1 PHENYLENE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1987-04-22 EP claimed
WO-1986005779-A1 PHENYLENE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-10-09 WO claimed
US-5140046-A Slow reacting substance of anaphylaxis antagonists YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1992-08-18 US disclosed
US-5116853-A SRS-Antagonist, Antiallergens MASE TOSHIYASU (JP) 1992-05-26 US disclosed
US-4994479-A Antagonists of SRS-A(slow reacting substance of anaphylaxis); antiallergens, antiischemic agents YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1991-02-19 US disclosed
EP-0218728-A1 PHENYLENE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1987-04-22 EP disclosed
WO-1986005779-A1 PHENYLENE DERIVATIVES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-10-09 WO disclosed