SCHEMBL9664375

SCHEMBL9664375

NCCCCSc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1

nearest known ligand 0.83

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACAT1 P24752 1/20 0.58
SOAT1 P35610 1/20 0.58
KDM4E B2RXH2 1/20 0.57

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
SCHEMBL9370570 0.99 ACAT1 (0.60) ACAT1SOAT1
SCHEMBL9664425 0.96 KDM4E (0.58) KDM4E
SCHEMBL9210387 0.93 KDM4E (0.64) ACAT1SOAT1KDM4E
SCHEMBL8476295 0.91 KDM4E (0.62) KDM4E
SCHEMBL9213347 0.91 ACAT1 (0.66) ACAT1SOAT1KDM4E
SCHEMBL9217701 0.91 ACAT1 (0.66) ACAT1SOAT1KDM4E
SCHEMBL9212895 0.91 ACAT1 (0.66) ACAT1SOAT1KDM4E
SCHEMBL9215059 0.90 KDM4E (0.64) KDM4E
SCHEMBL9215071 0.86 KDM4E (0.68) KDM4E
SCHEMBL9347989 0.85 KDM4E (0.59) ACAT1SOAT1KDM4E

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-0519996-A1 IMIDAZOLES RHONE-POULENC RORER LIMITED (GB) 1992-12-30 EP disclosed
EP-0505481-A1 2-SUBSTITUTED 4,5-DIPHENYL-IMIDAZOLES RHONE-POULENC SANTE (FR) 1992-09-30 EP disclosed
WO-1991013876-A1 IMIDAZOLES RHONE-POULENC RORER LIMITED (GB) 1991-09-19 WO disclosed
WO-1991009030-A1 2-SUBSTITUTED 4,5-DIPHENYL-IMIDAZOLES RHONE-POULENC SANTE (FR) 1991-06-27 WO disclosed