SCHEMBL4059464

SCHEMBL4059464

CC(C)(C)[C@H](NC(=O)c1nn(CC2CCOCC2)c2c(F)cccc12)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 11/20 0.49
CNR2 P34972 9/20 0.49
HTR4 Q13639 4/20 0.38
CYP3A4 P08684 1/20 0.38
HTR3A P46098 1/20 0.37

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
SCHEMBL4057752 0.91 CNR1 (0.57) CNR1CNR2
SCHEMBL4051582 0.91 CNR1 (0.42) CNR1CNR2HTR4CYP3A4HTR3A
SCHEMBL13690954 0.90 CNR1 (0.41) CNR1CNR2HTR4CYP3A4HTR3A
SCHEMBL13690587 0.89 HTR4 (0.42) CNR1CNR2HTR4CYP3A4HTR3A
SCHEMBL4059133 0.89 HTR4 (0.42) CNR1CNR2HTR4CYP3A4HTR3A
SCHEMBL13691151 0.89 CNR1 (0.42) CNR1CNR2HTR4CYP3A4HTR3A
SCHEMBL13690740 0.89 CNR1 (0.48) CNR1CNR2
SCHEMBL4052559 0.89 CNR1 (0.48) CNR1CNR2
SCHEMBL13691009 0.88 CNR1 (0.41) CNR1CNR2HTR4CYP3A4HTR3A
SCHEMBL4048417 0.88 CNR1 (0.41) CNR1CNR2HTR4CYP3A4HTR3A

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-2009106980-A2 INDAZOLE DERIVATIVES PFIZER INC. (US) 2009-09-03 WO claimed