SCHEMBL11002201

SCHEMBL11002201

Cc1ccc(C(=O)SC(=O)c2ccc(C)cc2C(=O)O)c(C(=O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.57
SORT1 Q99523 1/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
NOTUM Q6P988 2/20 0.43
ALDH1A1 P00352 2/20 0.43
GFER P55789 1/20 0.42
CLCN2 P51788 1/20 0.42
MCL1 Q07820 1/20 0.42
METAP2 P50579 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
MAOB P27338 1/20 0.41
CA5A P35218 1/20 0.41

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
SCHEMBL467550 0.85 CSNK2A1 (0.68) CSNK2A1SORT1PPARGPPARAMEN1
SCHEMBL31627797 0.85 CSNK2A1 (0.68) CSNK2A1SORT1PPARGPPARAMEN1
SCHEMBL4253511 0.83 CSNK2A1 (0.65) CSNK2A1SORT1PPARGPPARAMEN1
Hydrochloric Acid SCHEMBL6633682 0.83 CSNK2A1 (0.65) CSNK2A1SORT1PPARGPPARAMEN1
SCHEMBL6234004 0.83 CSNK2A1 (0.65) CSNK2A1SORT1PPARGPPARAMEN1
Methyl Alcohol SCHEMBL28948582 0.83 CSNK2A1 (0.65) CSNK2A1SORT1PPARGPPARAMEN1
Hydrochloric Acid SCHEMBL302205 0.83 CSNK2A1 (0.65) CSNK2A1SORT1PPARGPPARAMEN1
SCHEMBL775141 0.79 KMT2A (0.49) CSNK2A1MEN1KMT2AALDH1A1KDM4E
Mellitic Acid SCHEMBL15527813 0.79 CSNK2A1 (0.61) CSNK2A1SORT1PPARGPPARAMEN1
SCHEMBL12577332 0.79 CSNK2A1 (0.61) CSNK2A1SORT1PPARGPPARAMEN1

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
US-4560772-A Preparation of substituted phthalic anhydrides STAUFFER CHEMICAL COMPANY (US) 1985-12-24 US disclosed