SCHEMBL27626388

SCHEMBL27626388

OC1CN(c2ccc(Cl)cc2)C(c2ccccc2Cl)=N1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 2/20 0.45
CNR1 P21554 12/20 0.39
CNR2 P34972 5/20 0.39
ALDH1A1 P00352 2/20 0.38
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 1/20 0.38
BRD4 O60885 3/20 0.38
BRD2 P25440 3/20 0.38
BRD3 Q15059 3/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 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
SCHEMBL5594816 0.82 ALDH1A1 (0.43) ALDH1A1RAB9AHSD17B10BRD4BRD2
SCHEMBL8594325 0.78 PTGS2 (0.56)
SCHEMBL5594029 0.70 PTGS2 (0.62)
SCHEMBL5594300 0.70 PTGS2 (0.62)
SCHEMBL5593904 0.70 PTGS2 (0.62)
SCHEMBL5594820 0.70 PTGS2 (0.62)
SCHEMBL6335025 0.69 CNR1 (0.41) CNR1CNR2
SCHEMBL4220252 0.68 CNR1 (0.40) CNR1CNR2
Lithium Ion SCHEMBL4220249 0.68 CNR1 (0.40) CNR1CNR2
SCHEMBL6533942 0.67 CNR1 (0.39) CNR1CNR2KMT2A

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
CN-1777605-A Cannabined receptor ligands and uses thereof PFIZER (US) 2006-05-24 CN disclosed