SCHEMBL4049580

SCHEMBL4049580

CC(C)(C)[C@H](NC(=O)c1nn(CC(=O)NC2CCCCC2)c2ccccc12)C(=O)NCC(N)=O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.51
CNR2 P34972 2/20 0.51
CFD P00746 3/20 0.46
F10 P00742 1/20 0.43
HTR3A P46098 4/20 0.42
RAB9A P51151 1/20 0.42
IDO1 P14902 2/20 0.42
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL4051967 0.90 CNR1 (0.51) CNR1CNR2F10HTR3ARAB9A
SCHEMBL13690582 0.90 CNR1 (0.51) CNR1CNR2F10HTR3ARAB9A
SCHEMBL4051161 0.89 CNR1 (0.47) CNR1CNR2CFDF10HTR3A
SCHEMBL4049353 0.89 CNR1 (0.51) CNR1CNR2CFDHTR3A
SCHEMBL13690593 0.89 CNR1 (0.47) CNR1CNR2CFDF10HTR3A
SCHEMBL4051743 0.87 CNR1 (0.67) CNR1CNR2CFDHTR3A
SCHEMBL4054945 0.87 CNR1 (0.67) CNR1CNR2CFDHTR3A
SCHEMBL13691313 0.87 CNR1 (0.67) CNR1CNR2CFDHTR3A
SCHEMBL13690997 0.86 CNR1 (0.49) CNR1CNR2CFDHTR3A
SCHEMBL4052972 0.86 CNR1 (0.49) CNR1CNR2CFDHTR3A

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

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