SCHEMBL7601790

SCHEMBL7601790

CC(C)(C)Sc1cc[nH]c1SC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.31

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
SCHEMBL6934720 0.64 AOC3 (0.37) AOC3
SCHEMBL15427733 0.63 AOC3 (0.39) AOC3
SCHEMBL1275599 0.59 GSTP1 (0.34) AOC3
SCHEMBL7189127 0.57 CETP (0.34) AOC3
SCHEMBL1275601 0.57 GABRA1 (0.42) AOC3
SCHEMBL22759067 0.57 CYP2A6 (0.37) AOC3
SCHEMBL7930508 0.57 ACHE (0.43) AOC3
SCHEMBL10351684 0.57 AOC3 (0.32) AOC3
SCHEMBL7111480 0.56 LMNA (0.41)
SCHEMBL6863388 0.56 KMT2A (0.54)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708090-B1 Intermediates useful for the synthesis of pesticides AVENTIS CROPSCIENCE SA (FR) 2002-12-04 EP disclosed
US-6271392-B1 Intermediates useful for the synthesis of 1-arylpyrrole pesticides RHONE-POULENC INC. 2001-08-07 US disclosed
EP-0708090-A1 Intermediates useful for the synthesis of pesticides RHONE-POULENC AGROCHIMIE (FR) 1996-04-24 EP disclosed