SCHEMBL11401966

SCHEMBL11401966

CC1CCC2C[C@H](C)CC[C@@H]2C1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
TRPA1 O75762 2/20 0.36
TRPM8 Q7Z2W7 2/20 0.36
EPHX1 P07099 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
SCHEMBL14230816 1.00 L3MBTL1 (0.39) L3MBTL1TRPA1TRPM8EPHX1
SCHEMBL7553320 1.00 L3MBTL1 (0.39) L3MBTL1TRPA1TRPM8EPHX1
SCHEMBL6589750 0.93
SCHEMBL11704137 0.89 L3MBTL1 (0.38) L3MBTL1TRPA1TRPM8
SCHEMBL9441916 0.89 L3MBTL1 (0.38) L3MBTL1TRPA1TRPM8
SCHEMBL18404243 0.88
SCHEMBL4764671 0.87 ALDH1A1 (0.39) L3MBTL1TRPA1TRPM8
SCHEMBL17800105 0.87 ALDH1A1 (0.47) L3MBTL1TRPA1TRPM8
SCHEMBL5779865 0.87 ALDH1A1 (0.47) L3MBTL1TRPA1TRPM8
SCHEMBL9441857 0.87 ALDH1A1 (0.47) L3MBTL1TRPA1TRPM8

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
US-4300008-A TANTALUM PENTAFLUORIDE OR NIOBIUM PENTAFLUORIDE ISOMERIZATION CATALYSTS STANDARD OIL COMPANY (INDIANA) (US) 1981-11-10 US disclosed