SCHEMBL3972248

SCHEMBL3972248

Nc1scc(-c2ccccc2F)c1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 10/20 0.49
MEN1 O00255 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ADRB3 P13945 1/20 0.43
TSPO P30536 1/20 0.43
HTR7 P34969 1/20 0.43
TMEM97 Q5BJF2 1/20 0.43
PRKCZ Q05513 1/20 0.42
GRM1 Q13255 1/20 0.40
CDK2 P24941 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRA5 P31644 1/20 0.40
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL3976396 0.89 ALDH1A1 (0.44) ADORA1MEN1RAB9AKMT2AMAPT
SCHEMBL3972011 0.82 PRKCZ (0.57) ADORA1MEN1RAB9AKMT2AMAPT
SCHEMBL12465762 0.80 PRKCZ (0.47) MEN1RAB9AKMT2AMAPTSMN1; SMN2
SCHEMBL3974360 0.80 PRKCZ (0.62) ADORA1MEN1RAB9AKMT2AMAPT
SCHEMBL3972589 0.80 PRKCZ (0.55) ADORA1MEN1RAB9AKMT2AMAPT
SCHEMBL3976107 0.79 PRKCZ (0.58) ADORA1MEN1RAB9AKMT2AMAPT
SCHEMBL3980156 0.78 PRKCZ (0.45) ADORA1MEN1RAB9AKMT2AMAPT
SCHEMBL3975200 0.76 PRKCZ (0.48) ADORA1MEN1RAB9AKMT2AMAPT
SCHEMBL3974298 0.74 PRKCZ (0.59) ADORA1MEN1RAB9AKMT2AMAPT
SCHEMBL3976906 0.74 PRKCZ (0.55) ADORA1MEN1RAB9AKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009049362-A1 A1 ADENOSINE RECEPTOR ALLOSTERIC ENHANCERS MONASH UNIVERSITY (AU) 2009-04-23 WO claimed
WO-2009049362-A1 A1 ADENOSINE RECEPTOR ALLOSTERIC ENHANCERS MONASH UNIVERSITY (AU) 2009-04-23 WO disclosed
WO-2009049362-A1 A1 ADENOSINE RECEPTOR ALLOSTERIC ENHANCERS MONASH UNIVERSITY (AU) 2009-04-23 WO disclosed