SCHEMBL6973251

SCHEMBL6973251

Cc1cc(C)cc(Sc2c(C(C)C)nc(COC(N)=O)n2C)c1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
ALOX5 P09917 1/20 0.30
EPHX1 P07099 1/20 0.30

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
SCHEMBL6968839 0.89
SCHEMBL7086609 0.88 LMNA (0.31) LMNAKDM4EALDH1A1MAPK1SMN1; SMN2
SCHEMBL6961025 0.88 LMNA (0.36) LMNASMN1; SMN2
SCHEMBL6972884 0.88 LMNA (0.36) LMNA
SCHEMBL6960602 0.87 SMN1; SMN2 (0.37) LMNAALDH1A1SMN1; SMN2
SCHEMBL7085901 0.87 LMNA (0.32) LMNA
SCHEMBL6969825 0.87 LMNA (0.31) LMNA
SCHEMBL6963210 0.86 LMNA (0.30) LMNA
SCHEMBL6974730 0.85 ALDH1A1 (0.32) LMNAKDM4EALDH1A1SMN1; SMN2
SCHEMBL6969941 0.85 CYP1A2 (0.39) LMNASMN1; SMN2EPHX1

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-0786455-B1 IMIDAZOLE DERIVATIVE SHIONOGI & CO (JP) 2003-12-03 EP disclosed
US-6147097-A METHOD FOR TREATING AIDS SHIONOGI & CO., LTD. (JP) 2000-11-14 US disclosed
US-5910506-A IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC SHIONOGI & CO., LTD. (JP) 1999-06-08 US disclosed
EP-0786455-A1 IMIDAZOLE DERIVATIVE SHIONOGI & CO., LTD. (JP) 1997-07-30 EP disclosed