SCHEMBL7930895

SCHEMBL7930895

Cc1cn2cc(C(=O)NCc3nccs3)cc(-c3cccc(Cl)c3)c2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.43
STAMBP O95630 1/20 0.43
COPS5 Q92905 1/20 0.43
KDM4E B2RXH2 1/20 0.40
CHRM4 P08173 1/20 0.40
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
CNR2 P34972 4/20 0.39
CNR1 P21554 2/20 0.39
SCD O00767 2/20 0.38
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ACKR3 P25106 1/20 0.37
GRM5 P41594 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
ADORA2A P29274 1/20 0.37

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
SCHEMBL7934017 0.81 NPC1 (0.53) KDM4EPOLBRAB9AGAAMAPK1
SCHEMBL7929316 0.77 GCK (0.62) KDM4EPOLBRAB9ASCDALDH1A1
SCHEMBL7930732 0.77 CNR2 (0.53) KDM4ERAB9ACNR2ALDH1A1GRM5
SCHEMBL7930354 0.77 SMN1; SMN2 (0.47) KDM4EPOLBCNR2ALDH1A1GRM5
SCHEMBL7931544 0.77 CNR2 (0.50) KDM4EPOLBRAB9ACNR2GAA
SCHEMBL3377892 0.76 GRM5 (0.57) KDM4ERAB9AGAAALDH1A1GRM5
SCHEMBL3377871 0.76 MAPK14 (0.46) KDM4ERAB9AALDH1A1GRM5
SCHEMBL7930350 0.75 POLB (0.51) PSMD14POLBRAB9AGAA
SCHEMBL7922479 0.74 JAK2 (0.46) GAAGRM5
SCHEMBL7929299 0.73 KCNQ3 (0.43) GRM5

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-2010059836-A1 SUBSTITUTED AZA-BRIDGED BICYCLICS FOR CARDIOVASCULAR AND CNS DISEASE DECODE GENETICS EHF (IS) 2010-05-27 WO disclosed