SCHEMBL9302131

SCHEMBL9302131

CN(C(=O)c1ccc(Cn2c(-c3cscn3)nc3ccccc32)cc1)C1CCCCC1

nearest known ligand 0.71

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 2/20 0.71
HRH3 Q9Y5N1 10/20 0.56
KDM4E B2RXH2 3/20 0.52
HSD17B10 Q99714 1/20 0.52
MAPT P10636 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.46

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
SCHEMBL9301924 0.85 PTAFR (0.80) PTAFRHRH3ALDH1A1
SCHEMBL9301610 0.83 PTAFR (1.00) PTAFRHRH3
SCHEMBL9303512 0.82 PTAFR (0.76) PTAFRHRH3ALDH1A1LMNA
SCHEMBL9305049 0.81 PTAFR (0.77) PTAFRHRH3
SCHEMBL9302757 0.81 PTAFR (0.77) PTAFRHRH3MEN1KMT2A
SCHEMBL9301705 0.80 PTAFR (0.75) PTAFRHRH3
SCHEMBL9302862 0.80 PTAFR (0.78) PTAFRHRH3
SCHEMBL9301789 0.79 PTAFR (0.77) PTAFRHRH3KDM4EMEN1KMT2A
SCHEMBL9302148 0.78 PTAFR (0.75) PTAFRHRH3
SCHEMBL9302551 0.78 PTAFR (0.74) PTAFRHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP claimed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO claimed
US-5314880-A Platelet activating factor antagonist BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-05-24 US disclosed
EP-0468971-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-02-05 EP disclosed
WO-1990009997-A1 NOVEL BENZIMIDAZOLE DERIVATIVES BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-09-07 WO disclosed