SCHEMBL24540591

SCHEMBL24540591

COC(=O)c1ccc(CCNC(=O)[C@@H]2C[C@H](C)CC[C@H]2C(C)C)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 5/20 0.51
MGLL Q99685 1/20 0.43
SERPINE1 P05121 1/20 0.42
TRPV1 Q8NER1 3/20 0.41
EPHX1 P07099 1/20 0.41
MAPT P10636 2/20 0.41
CYP4A11 Q02928 2/20 0.40
TLR2 O60603 1/20 0.40
TLR1 Q15399 1/20 0.40
LMNA P02545 1/20 0.40
CYP4F2 P78329 1/20 0.40

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
SCHEMBL13989024 0.89 TRPM8 (0.53) TRPM8SERPINE1TRPV1EPHX1LMNA
SCHEMBL2628712 0.89 TRPM8 (0.50) TRPM8TRPV1EPHX1
SCHEMBL14664195 0.88 TRPM8 (0.67) TRPM8TRPV1LMNA
SCHEMBL2628703 0.88 TRPM8 (0.67) TRPM8TRPV1LMNA
SCHEMBL15131619 0.88 TRPM8 (0.67) TRPM8TRPV1LMNA
SCHEMBL24540509 0.88 TRPM8 (0.47) TRPM8SERPINE1TRPV1MAPTCYP4A11
SCHEMBL24540840 0.88 TRPM8 (0.47) TRPM8SERPINE1TRPV1MAPTCYP4A11
SCHEMBL24540473 0.86 TRPM8 (0.49) TRPM8TRPV1EPHX1
SCHEMBL2628667 0.86 TRPM8 (0.50) TRPM8EPHX1
SCHEMBL2628617 0.86 TRPM8 (0.49) TRPM8TRPV1EPHX1

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
WO-2022133027-A1 SUBSTITUTED CYCLOHEXANECARBOXAMIDES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2022-06-23 WO disclosed