SCHEMBL25890389

SCHEMBL25890389

CC(C)(C)OC(=O)NC1(C(=O)Nc2cncc(C(F)(F)F)c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.44
TRPV1 Q8NER1 2/20 0.44
AR P10275 1/20 0.42
SCN10A Q9Y5Y9 3/20 0.40
GHSR Q92847 1/20 0.40
FPR2 P25090 1/20 0.39
BDKRB1 P46663 5/20 0.39
RORC P51449 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
SLC22A6 Q4U2R8 1/20 0.37
SLC22A8 Q8TCC7 1/20 0.37
SLC22A12 Q96S37 1/20 0.37
SLC22A11 Q9NSA0 1/20 0.37
TAS2R14 Q9NYV8 1/20 0.37
BIRC3 Q13489 1/20 0.36
MALT1 Q9UDY8 1/20 0.36

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
SCHEMBL31654583 1.00 FAAH (0.44) FAAHTRPV1ARSCN10AGHSR
SCHEMBL31654157 0.85 FPR2 (0.54) FAAHGHSRFPR2BDKRB1RORC
SCHEMBL25890393 0.83 FPR2 (0.41) FAAHTRPV1GHSRFPR2BDKRB1
SCHEMBL31654381 0.83 FPR2 (0.41) FAAHTRPV1GHSRFPR2BDKRB1
SCHEMBL21580291 0.83 TAS2R14 (0.44) FAAHTRPV1ARSCN10AFPR2
SCHEMBL31654116 0.83 FAAH (0.42) FAAHTRPV1ARSCN10AGHSR
SCHEMBL21581186 0.83 FAAH (0.45) FAAHTRPV1GHSRBDKRB1RXFP1
SCHEMBL25890390 0.83 FAAH (0.42) FAAHTRPV1ARSCN10AGHSR
SCHEMBL2694023 0.83 AR (0.50) ARSCN10ARORCRXFP1CYP3A4
SCHEMBL29661790 0.79 TRPV1 (0.49) FAAHTRPV1BDKRB1TAS2R14

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-2023133336-A1 STAT MODULATORS AND USES THEREOF RECLUDIX PHARMA, INC. (US) 2023-07-13 WO disclosed