SCHEMBL9514707

SCHEMBL9514707

CC1CCC(C(C)C)C(S(=O)(=O)N(CCO)CCO)C1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 4/20 0.41
TRPA1 O75762 2/20 0.41
EPHX1 P07099 3/20 0.40
ALDH1A1 P00352 1/20 0.33
CYP19A1 P11511 2/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
TRPV1 Q8NER1 3/20 0.32
KCNA5 P22460 1/20 0.31
LMNA P02545 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
SCHEMBL1674809 0.74 TRPM8 (0.52) TRPM8TRPA1EPHX1CA1CA2
SCHEMBL6911471 0.72 TRPM8 (0.48) TRPM8TRPA1EPHX1ALDH1A1CA1
SCHEMBL11855364 0.71 TRPM8 (0.47) TRPM8TRPA1EPHX1ALDH1A1CA1
SCHEMBL2123054 0.71 EPHX1 (0.49) TRPM8TRPA1EPHX1ALDH1A1CA1
SCHEMBL5680417 0.70 TRPM8 (0.47) TRPM8TRPA1EPHX1ALDH1A1CYP19A1
SCHEMBL11412976 0.70 EPHX1 (0.57) TRPM8TRPA1EPHX1ALDH1A1CYP19A1
SCHEMBL18626368 0.68 TRPM8 (0.52) TRPM8TRPA1EPHX1ALDH1A1CA1
SCHEMBL6129335 0.67 TRPM8 (0.43) TRPM8EPHX1ALDH1A1CA1CA2
SCHEMBL17038527 0.67 TRPM8 (0.40) TRPM8TRPA1EPHX1ALDH1A1CYP19A1
SCHEMBL19928371 0.67 TRPM8 (0.40) TRPM8TRPA1EPHX1ALDH1A1CYP19A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0304886-B1 Oligomer benzil ketals and their use as photoinitiators CIBA GEIGY AG (CH) 1993-12-08 EP disclosed
EP-0304886-A2 Oligomer benzil ketals and their use as photoinitiators CIBA-GEIGY AG (CH) 1989-03-01 EP disclosed