SCHEMBL30831886

SCHEMBL30831886

COc1c(Cl)ccc(Cl)c1C(=O)ONC(C)=O

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.57
▸ KDM4E B2RXH2 2/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ TSHR P16473 1/20 0.55
▸ TAS1R3 Q7RTX0 7/20 0.50
▸ TAS1R1 Q7RTX1 7/20 0.50
▸ TAS1R2 Q8TE23 5/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ MAPT P10636 1/20 0.41
▸ GAA P10253 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ HSD17B1 P14061 1/20 0.36
▸ HSD17B2 P37059 1/20 0.36

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
SCHEMBL27198408 1.00 ALDH1A1 (0.57) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
SCHEMBL29786169 0.87 ALDH1A1 (0.57) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
SCHEMBL27198361 0.87 ALDH1A1 (0.57) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
SCHEMBL8417269 0.83 ALDH1A1 (0.61) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
SCHEMBL162688 0.83 ALDH1A1 (0.69) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
SCHEMBL29613143 0.83 ALDH1A1 (0.69) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
SCHEMBL27198382 0.81 ALDH1A1 (0.55) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
SCHEMBL29786130 0.81 ALDH1A1 (0.55) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
SCHEMBL30831899 0.79 ALDH1A1 (0.69) ALDH1A1KDM4EHSD17B10TSHRTAS1R3
SCHEMBL27198356 0.79 ALDH1A1 (0.69) ALDH1A1KDM4EHSD17B10TSHRTAS1R3

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-117813004-A Auxin herbicide and application method thereof 科迪华农业科技有限责任公司 2024-04-02 — — CN disclosed
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