SCHEMBL14822018

SCHEMBL14822018

O=C(/C=C\CCc1ccc(O)c(O)c1)N(c1ccccn1)C1CCCCC1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 10/20 0.57
ALDH1A1 P00352 5/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
LMNA P02545 2/20 0.53
HTT P42858 1/20 0.53
KDM4E B2RXH2 2/20 0.51
POLB P06746 1/20 0.51
MAPT P10636 1/20 0.50
CACNA1B Q00975 1/20 0.50
APBA1 Q02410 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NPC1 O15118 1/20 0.44

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
SCHEMBL14822015 1.00 TRPM8 (0.57) TRPM8ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL14821809 0.90 TRPM8 (0.59) TRPM8ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL14821815 0.90 TRPM8 (0.59) TRPM8ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL15276727 0.85 TRPM8 (0.69) TRPM8ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL15276723 0.85 TRPM8 (0.69) TRPM8ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL14822016 0.83 TRPM8 (0.69) TRPM8ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL14821807 0.81 TRPM8 (0.61) TRPM8ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL10270341 0.81 TRPM8 (0.76) TRPM8ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL14821810 0.80 TRPM8 (0.52) TRPM8ALDH1A1SMN1; SMN2LMNAHTT
SCHEMBL14821797 0.80 TRPM8 (0.52) TRPM8ALDH1A1SMN1; SMN2LMNAHTT

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-2013041621-A1 LOW MOLECULAR WEIGHT MODULATORS OF THE COLD-MENTHOL RECEPTOR TRPM8 AND USE THEREOF BASF SE (DE) 2013-03-28 WO disclosed