SCHEMBL19946409

SCHEMBL19946409

O=C(Nc1ccc(C(F)(F)F)cc1)N1CCC(F)(CCCc2ccccc2)CC1.O=C(Nc1ccc(C(F)(F)F)cc1)N1CCC(F)(c2ncccn2)CC1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 13/20 0.57
▸ FAAH O00519 1/20 0.47
▸ PRKAB2 O43741 1/20 0.47
▸ PRKAG1 P54619 1/20 0.47
▸ PRKAA2 P54646 1/20 0.47
▸ PRKAA1 Q13131 1/20 0.47
▸ PRKAG3 Q9UGI9 1/20 0.47
▸ PRKAG2 Q9UGJ0 1/20 0.47
▸ PRKAB1 Q9Y478 1/20 0.47
▸ EPHX2 P34913 1/20 0.46
▸ TRPM8 Q7Z2W7 1/20 0.45
▸ NAMPT P43490 1/20 0.45

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
SCHEMBL2723774 0.91 FAAH (0.55) TRPV1FAAHPRKAB2PRKAG1PRKAA2
SCHEMBL2723735 0.86 TRPV1 (0.73) TRPV1EPHX2TRPM8NAMPT
SCHEMBL19946410 0.83 TRPV1 (0.47) TRPV1
SCHEMBL31679068 0.77 TRPV1 (0.69) TRPV1EPHX2TRPM8NAMPT
SCHEMBL2723508 0.77 TRPV1 (0.69) TRPV1EPHX2TRPM8NAMPT
SCHEMBL2724878 0.75 TRPV1 (0.63) TRPV1FAAHPRKAB2PRKAG1PRKAA2
SCHEMBL27645808 0.74 NPC1 (0.43) FAAHEPHX2NAMPT
SCHEMBL2731876 0.74 TRPV1 (0.59) TRPV1FAAHPRKAB2PRKAG1PRKAA2
SCHEMBL2727164 0.73 TRPV1 (0.79) TRPV1EPHX2TRPM8
SCHEMBL2723660 0.73 TRPV1 (0.79) TRPV1TRPM8

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-2635281-B1 METHODS AND COMPOSITIONS FOR PREVENTION AND TREATMENT OF CARDIAC HYPERTROPHY UNIV HAWAII (US) 2018-03-14 — — EP disclosed
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