SCHEMBL3410967

SCHEMBL3410967

CCc1ccccc1C(=O)OOOC(C)(C)C

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.45
TSHR P16473 7/20 0.45
TDP1 Q9NUW8 2/20 0.45
HSD17B10 Q99714 2/20 0.45
LMNA P02545 2/20 0.40
UTS2R Q9UKP6 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPK1 P28482 1/20 0.36
CLCN2 P51788 1/20 0.36
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35

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
SCHEMBL28661989 0.88 ALDH1A1 (0.41) ALDH1A1TSHRTDP1HSD17B10LMNA
SCHEMBL629428 0.86 TSHR (0.53) ALDH1A1TSHRTDP1HSD17B10LMNA
SCHEMBL29390328 0.86 TSHR (0.53) ALDH1A1TSHRTDP1HSD17B10LMNA
SCHEMBL6464901 0.82 TSHR (0.52) ALDH1A1TSHRTDP1HSD17B10LMNA
SCHEMBL27927975 0.82 ALDH1A1 (0.42) ALDH1A1TSHRTDP1HSD17B10LMNA
SCHEMBL27458878 0.81 ALDH1A1 (0.41) ALDH1A1TSHRTDP1HSD17B10LMNA
SCHEMBL5435699 0.80 ALDH1A1 (0.51) ALDH1A1TSHRTDP1HSD17B10LMNA
SCHEMBL544515 0.80 TSHR (0.47) ALDH1A1TSHRTDP1HSD17B10LMNA
SCHEMBL951581 0.80 TSHR (0.46) ALDH1A1TSHRTDP1HSD17B10LMNA
SCHEMBL28403038 0.79 TSHR (0.51) ALDH1A1TSHRTDP1HSD17B10LMNA

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-9187578-B2 Polymer modified pigment and production process of the same DIC CORPORATION (JP) 2015-11-17 US disclosed
US-20100267894-A1 POLYMER MODIFIED PIGMENT AND PRODUCTION PROCESS OF THE SAME DIC CORPORATION (JP) 2010-10-21 US disclosed