SCHEMBL16404248

SCHEMBL16404248

Cc1nc(C(=O)N[C@H](C)c2ccccc2)c(C)n1-c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 10/20 0.60
CNR2 P34972 10/20 0.60
ALDH1A1 P00352 4/20 0.52
GRM5 P41594 4/20 0.49
POLB P06746 1/20 0.49
HTT P42858 1/20 0.49
MAPK1 P28482 1/20 0.47
HTR2A P28223 2/20 0.46
HTR2C P28335 2/20 0.46
SLC6A4 P31645 2/20 0.46

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
SCHEMBL16404207 0.92 GRM5 (0.57) CNR1CNR2ALDH1A1GRM5
SCHEMBL3684239 0.77 CNR1 (0.57) CNR1CNR2ALDH1A1GRM5HTT
SCHEMBL23889217 0.75 CNR1 (0.56) CNR1CNR2ALDH1A1GRM5HTT
SCHEMBL4961512 0.75 CNR1 (0.55) CNR1CNR2ALDH1A1GRM5POLB
SCHEMBL16063426 0.74 CNR1 (0.54) CNR1CNR2ALDH1A1GRM5HTT
SCHEMBL30387595 0.73 WNT3A (0.61) CNR1CNR2GRM5
SCHEMBL20604171 0.73 WNT3A (0.61) CNR1CNR2GRM5
Lithium Ion SCHEMBL1078086 0.73 CNR2 (0.56) CNR1CNR2GRM5HTTMAPK1
SCHEMBL16404239 0.73 CNR2 (0.60) CNR1CNR2HTR2AHTR2CSLC6A4
SCHEMBL16404211 0.73 CNR1 (0.68) CNR1CNR2GRM5HTR2AHTR2C

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
US-8937184-B2 1H-imidazole derivatives as cannabinoid CB2 receptor modulators ABBVIE B.V. (NL) 2015-01-20 US disclosed
US-8937184-B2 1H-imidazole derivatives as cannabinoid CB2 receptor modulators ABBVIE B.V. (NL) 2015-01-20 US disclosed