SCHEMBL29112414

SCHEMBL29112414

CC1CCC(C(C)C)[C@@](O)(C(N)=O)C1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.39
HSD11B1 P28845 4/20 0.30
TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL30626433 1.00 EPHX1 (0.39) EPHX1HSD11B1TRPV1
SCHEMBL305653 1.00 EPHX1 (0.39) EPHX1HSD11B1TRPV1
Lactic Acid SCHEMBL306590 0.92 EPHX1 (0.34) EPHX1
SCHEMBL29682105 0.84 HSD11B1 (0.33) EPHX1HSD11B1TRPV1
SCHEMBL7978200 0.84 HSD11B1 (0.33) EPHX1HSD11B1TRPV1
SCHEMBL29112277 0.84 HSD11B1 (0.33) EPHX1HSD11B1TRPV1
SCHEMBL9129161 0.80 EPHX1 (0.40) EPHX1HSD11B1TRPV1
SCHEMBL6276859 0.79 ALDH1A1 (0.44) EPHX1
SCHEMBL2313131 0.79 EPHX1 (0.39) EPHX1HSD11B1TRPV1
SCHEMBL25423984 0.77 EPHX1 (0.38) EPHX1

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-116829532-A Substituted cyclohexane carboxamides, their preparation and their therapeutic use 赛诺菲 2023-09-29 CN disclosed