SCHEMBL3360201

SCHEMBL3360201

Cc1[nH]c(Cc2ccc(Cl)cc2)nc1-c1ccc2ccccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
PRNP P04156 1/20 0.44
NR1H2 P55055 1/20 0.43
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.41
NPY5R Q15761 3/20 0.40
IKBKB O14920 1/20 0.38
NR1I3 Q14994 1/20 0.38
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
CYP2A6 P11509 1/20 0.38
ALKBH3 Q96Q83 1/20 0.37
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
MAPK10 P53779 1/20 0.37
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36

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
SCHEMBL26111108 0.92 PTGDR2 (0.48) MAPTPRNPNR1H2NPC1LMNA
SCHEMBL28807045 0.90 IKBKB (0.41) MAPTNR1H2NPC1LMNARAB9A
SCHEMBL3359090 0.89 GAA (0.43) MAPTNR1H2NPC1LMNARAB9A
SCHEMBL3362875 0.87 PDE5A (0.45) PRNPNPY5RALKBH3ADORA2AADORA1
SCHEMBL27915197 0.87 ADORA2A (0.43) MAPTNPC1LMNARAB9ASMN1; SMN2
SCHEMBL2871465 0.86 NPY5R (0.48) MAPTPRNPNR1H2LMNASMN1; SMN2
SCHEMBL27915187 0.85 HTT (0.40) LMNASMN1; SMN2NPY5RIKBKBNR1I3
SCHEMBL27933713 0.85 CYP2A6 (0.37) MAPTLMNANPY5RIKBKBNR1I3
SCHEMBL2868874 0.85 PRNP (0.49) MAPTPRNPNR1H2NPC1LMNA
SCHEMBL2867282 0.85 NR1H2 (0.55) MAPTPRNPNR1H2NPC1LMNA

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-2010024421-A1 SURFACE TREATING AGENT FOR COPPER OR COPPER ALLOY AND USE THEREOF SHIKOKU CHEMICALS CORPORATION (JP) 2010-03-04 WO disclosed