SCHEMBL3939141

SCHEMBL3939141

CC(C)CN1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.74

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 11/20 0.74
TRPV1 Q8NER1 1/20 0.46
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
POLB P06746 1/20 0.41
CCNE2 O96020 1/20 0.40
CCNE1 P24864 1/20 0.40
CDK2 P24941 1/20 0.40
TNF P01375 1/20 0.40
MAPT P10636 1/20 0.39
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
GRM4 Q14833 1/20 0.39
HTR7 P34969 1/20 0.38
HTR6 P50406 1/20 0.38

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
SCHEMBL4019421 0.92 FAAH (0.70) FAAHTRPV1CCNE2CCNE1CDK2
SCHEMBL4019416 0.92 FAAH (0.70) FAAHTRPV1CCNE2CCNE1CDK2
SCHEMBL3939127 0.91 FAAH (0.72) FAAHTRPV1CCNE2CCNE1CDK2
SCHEMBL3937880 0.86 FAAH (0.74) FAAHTRPV1CDK2TNFGRM4
SCHEMBL3931765 0.85 FAAH (0.79) FAAHTRPV1GRM4HTR7HTR6
SCHEMBL4012669 0.85 FAAH (0.79) FAAHTRPV1CCNE2CCNE1CDK2
SCHEMBL3933752 0.85 FAAH (0.89) FAAH
SCHEMBL3936220 0.85 FAAH (1.00) FAAHTP53MAPT
SCHEMBL3935343 0.83 FAAH (0.89) FAAH
SCHEMBL3937615 0.83 FAAH (1.00) FAAHHTR7HTR6

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-2009011904-A1 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2009-01-22 WO disclosed