SCHEMBL22100712

SCHEMBL22100712

Cc1ccc(/C=C/C(=O)N(c2ccccc2)C2CCCCC2)cc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 13/20 0.82
ALDH1A1 P00352 4/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
LMNA P02545 1/20 0.54
HTR2A P28223 1/20 0.53
HTR2C P28335 1/20 0.53
HTR2B P41595 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
KDM4E B2RXH2 3/20 0.50
MAPT P10636 1/20 0.50
CACNA1B Q00975 1/20 0.50
APBA1 Q02410 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
MITF O75030 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
PAX8 Q06710 1/20 0.49
POLB P06746 1/20 0.48

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
SCHEMBL20250760 0.93 TRPM8 (0.71) TRPM8ALDH1A1SMN1; SMN2HTR2AHTR2C
SCHEMBL1699151 0.91 TRPM8 (1.00) TRPM8ALDH1A1SMN1; SMN2LMNAHTR2A
SCHEMBL1699149 0.91 TRPM8 (1.00) TRPM8ALDH1A1SMN1; SMN2LMNAHTR2A
SCHEMBL10270947 0.86 TRPM8 (1.00) TRPM8ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL20777249 0.83 TRPM8 (0.57) TRPM8ALDH1A1SMN1; SMN2LMNAHTR2A
SCHEMBL22074394 0.83 TRPM8 (0.57) TRPM8ALDH1A1SMN1; SMN2LMNAHTR2A
SCHEMBL30579664 0.83 TRPM8 (0.57) TRPM8ALDH1A1SMN1; SMN2LMNAHTR2A
SCHEMBL20773809 0.83 TRPM8 (0.62) TRPM8ALDH1A1SMN1; SMN2LMNAKDM4E
SCHEMBL10270350 0.82 TRPM8 (0.74) TRPM8ALDH1A1SMN1; SMN2LMNAHTR2A
SCHEMBL13277324 0.82 TRPM8 (1.00) TRPM8ALDH1A1SMN1; SMN2LMNAKDM4E

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
EP-2501761-B1 USE OF PHYSIOLOGICAL COOLING ACTIVE INGREDIENTS, AND AGENTS CONTAINING SUCH ACTIVE INGREDIENTS SYMRISE AG (DE) 2020-06-17 EP disclosed