SCHEMBL12177690

SCHEMBL12177690

Cc1ccc(-c2csc(/C=C3\SC(=O)N(Cc4ccccc4)C3=O)c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 10/20 0.59
▸ ALDH1A1 P00352 1/20 0.57
▸ MEN1 O00255 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ ENPP2 Q13822 3/20 0.52
▸ RGS4 P49798 1/20 0.48
▸ PTPN1 P18031 2/20 0.45
▸ ACP1 P24666 1/20 0.45

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
SCHEMBL12177155 0.92 PPARG (0.63) PPARGALDH1A1ENPP2PTPN1ACP1
SCHEMBL12177349 0.90 PPARG (0.64) PPARGALDH1A1ENPP2PTPN1ACP1
SCHEMBL12177366 0.88 ENPP2 (0.54) PPARGALDH1A1MEN1KMT2AENPP2
SCHEMBL12177128 0.87 PTPN1 (0.61) PPARGENPP2PTPN1ACP1
SCHEMBL12177171 0.86 PPARG (0.71) PPARGALDH1A1MEN1LMNAKMT2A
SCHEMBL12177742 0.83 PPARG (0.68) PPARGALDH1A1MEN1LMNAKMT2A
SCHEMBL6689181 0.82 PPARG (0.70) PPARGALDH1A1MEN1LMNAKMT2A
SCHEMBL6689183 0.82 PPARG (0.70) PPARGALDH1A1MEN1LMNAKMT2A
SCHEMBL12177484 0.82 PPARG (0.55) PPARGALDH1A1MEN1KMT2AENPP2
SCHEMBL12177427 0.82 PPARG (0.67) PPARGALDH1A1MEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011135303-A2 UBIQUITINATION MODULATORS ITI SCOTLAND LIMITED (GB) 2011-11-03 — — WO disclosed
Send feedback