SCHEMBL14422202

SCHEMBL14422202

O=C(Nc1ccc(C(F)(F)F)cc1)c1nc(Nc2c(Cl)cccc2Cl)sc1Br

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 13/20 0.50
▸ ALDH1A1 P00352 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ AHR P35869 1/20 0.47
▸ PTGES O14684 2/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ ALOX5 P09917 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ ATF1 P18846 1/20 0.42
▸ NFKB1 P19838 1/20 0.42

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
SCHEMBL14422249 0.79 MAPT (0.58) TRPV1ALDH1A1LMNAHTTAHR
SCHEMBL14422258 0.73 MAPT (0.54) TRPV1LMNAAHRALOX5
SCHEMBL16761992 0.71 TRPV1 (0.67) TRPV1NPC1RAB9A
SCHEMBL5221352 0.71 TRPV1 (0.44) TRPV1
SCHEMBL14422192 0.70 MAPT (0.58) TRPV1LMNAAHRPTGESSMN1; SMN2
SCHEMBL25257907 0.70 KCNQ3 (0.54) TRPV1LMNAAHRSMN1; SMN2NPC1
SCHEMBL30184161 0.70 KCNQ3 (0.54) TRPV1LMNAAHRSMN1; SMN2NPC1
SCHEMBL14427857 0.70 MAPT (0.50) TRPV1LMNAAHRPTGESALOX5
SCHEMBL17448401 0.70 POLB (0.64) TRPV1ALDH1A1LMNAAHRSMN1; SMN2
SCHEMBL17152729 0.70 SMN1; SMN2 (0.56) TRPV1LMNAAHRSMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7265138-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2007-09-04 — — US disclosed
US-7265138-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2007-09-04 — — US disclosed
EP-1818333-A1 Vanilloid receptor ligands and their use in treatments Amgen Inc. (US) 2007-08-15 — — EP disclosed
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