SCHEMBL7150962

SCHEMBL7150962

Cc1c(C(=O)O)ccc(O)c1C(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.46
SELL P14151 1/20 0.45
SELP P16109 1/20 0.45
MYC P01106 2/20 0.41
GRM1 Q13255 1/20 0.41
MCL1 Q07820 3/20 0.41
ALDH1A1 P00352 4/20 0.39
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA7 P43166 3/20 0.39
CA9 Q16790 3/20 0.39
CA14 Q9ULX7 3/20 0.39
PTGS2 P35354 2/20 0.39
ALOX5 P09917 1/20 0.39
TSHR P16473 1/20 0.39
LDHA P00338 2/20 0.39
LDHB P07195 2/20 0.39
ALB P02768 1/20 0.39
GABRP O00591 1/20 0.39

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
SCHEMBL15123952 0.86 CYP1A2 (0.42) CSNK2A1SELLSELPMYCGRM1
SCHEMBL6838116 0.84 SELL (0.48) CSNK2A1SELLSELPGRM1MCL1
SCHEMBL27124386 0.82 SELL (0.57) CSNK2A1SELLSELPGRM1MCL1
SCHEMBL39247 0.78 SELL (0.57) CSNK2A1SELLSELPGRM1MCL1
SCHEMBL30443442 0.77 SELL (0.54) CSNK2A1SELLSELPMYCMCL1
SCHEMBL317575 0.77 SELL (0.54) CSNK2A1SELLSELPMYCMCL1
SCHEMBL21195120 0.77 TRPA1 (0.39) MCL1ALDH1A1CA1CA2PTGS2
SCHEMBL1950385 0.77 CYP1A2 (0.50) SELLSELPGRM1ALDH1A1CA12
SCHEMBL4625546 0.76 CSNK2A1 (0.39) CSNK2A1SELLSELPMYCGRM1
SCHEMBL30589153 0.75 SELL (0.64) CSNK2A1SELLSELPMYCGRM1

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
US-6525006-B2 Can be used to metal processing such as cutting, grinding and plastic working KYODO YUSHI CO., LTD. (JP) 2003-02-25 US disclosed
US-20020193263-A1 Lubricant composition KYODO YUSHI CO., LTD. (JP) 2002-12-19 US disclosed