SCHEMBL9675362

SCHEMBL9675362

Cc1ccc(-c2nc(SCCCN3C(=O)COCC3=O)[nH]c2-c2ccc(C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.49
▸ MAPT P10636 2/20 0.49
▸ ACAT1 P24752 1/20 0.46
▸ SOAT1 P35610 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ GPR55 Q9Y2T6 1/20 0.44
▸ MAPK14 Q16539 1/20 0.43

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
SCHEMBL9676486 0.89 ACAT1 (0.53) KDM4EACAT1SOAT1
SCHEMBL9674747 0.87 KDM4E (0.48) KDM4EMAPTACAT1SOAT1ALDH1A1
SCHEMBL9674683 0.85 ACAT1 (0.57) KDM4EACAT1SOAT1
SCHEMBL9674391 0.81 KDM4E (0.45) KDM4EMAPTACAT1SOAT1ALDH1A1
SCHEMBL9674634 0.81 ACAT1 (0.53) KDM4EACAT1SOAT1
SCHEMBL9674220 0.79 ACAT1 (0.54) KDM4EACAT1SOAT1
SCHEMBL9673987 0.77 ACAT1 (0.53) ACAT1SOAT1
SCHEMBL9674584 0.77 ACAT1 (0.53) ACAT1SOAT1
SCHEMBL9675945 0.76 LMNA (0.54) KDM4EACAT1SOAT1
SCHEMBL9674609 0.76 CYP1A2 (0.54) KDM4EACAT1SOAT1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505481-A1 2-SUBSTITUTED 4,5-DIPHENYL-IMIDAZOLES RHONE-POULENC SANTE (FR) 1992-09-30 — — EP disclosed
WO-1991009030-A1 2-SUBSTITUTED 4,5-DIPHENYL-IMIDAZOLES RHONE-POULENC SANTE (FR) 1991-06-27 — — WO disclosed
Send feedback