SCHEMBL31521298

SCHEMBL31521298

Cc1cccc(O)c1-c1c(C)cccc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.62
ATM Q13315 1/20 0.62
ALDH1A1 P00352 5/20 0.55
HPGD P15428 4/20 0.45
ALOX15 P16050 4/20 0.45
HSD17B10 Q99714 4/20 0.45
TDP1 Q9NUW8 4/20 0.45
CA2 P00918 4/20 0.45
LMNA P02545 3/20 0.45
RECQL P46063 3/20 0.45
CA1 P00915 3/20 0.45
EGFR P00533 2/20 0.45
FYN P06241 2/20 0.45
MMP9 P14780 2/20 0.45
ADAMTS4 O75173 1/20 0.45
MMP2 P08253 1/20 0.45
MMP8 P22894 1/20 0.45
CA6 P23280 1/20 0.45
CDK2 P24941 1/20 0.45
MMP12 P39900 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
SCHEMBL29763174 1.00 TRPA1 (0.62) TRPA1ATMALDH1A1HPGDALOX15
SCHEMBL109980 1.00 TRPA1 (0.62) TRPA1ATMALDH1A1HPGDALOX15
SCHEMBL11024469 0.97 TRPA1 (0.59) TRPA1ATMALDH1A1HPGDALOX15
SCHEMBL7637942 0.92 TRPA1 (0.59) TRPA1ATMALDH1A1HPGDALOX15
SCHEMBL17448425 0.86 TRPA1 (0.48) TRPA1ATMALDH1A1HPGDALOX15
SCHEMBL10466534 0.86 TRPA1 (0.48) TRPA1ATMALDH1A1HPGDALOX15
SCHEMBL17753428 0.84 TRPA1 (0.52) TRPA1ATMALDH1A1HPGDALOX15
SCHEMBL7583763 0.83 TRPA1 (0.50) TRPA1ATMALDH1A1HPGDALOX15
SCHEMBL984662 0.83 TRPA1 (0.50) TRPA1ATMALDH1A1HPGDALOX15
SCHEMBL13879427 0.83 TRPA1 (0.50) TRPA1ATMALDH1A1HPGDALOX15

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
CN-119790104-A Thermoplastic resin composition and molded article produced therefrom 乐天化学株式会社 2025-04-08 CN disclosed