SCHEMBL7928993

SCHEMBL7928993

Cc1nc2c(-c3cccc(Cl)c3)cc(Cc3ccc(N)nc3)cn2n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 3/20 0.40
DHFR P00374 1/20 0.38
NPC1 O15118 3/20 0.37
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
MEN1 O00255 1/20 0.35
KDR P35968 2/20 0.35
PTPN11 Q06124 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
TDO2 P48775 1/20 0.34
ABL1 P00519 1/20 0.34
EGFR P00533 1/20 0.34
SRC P12931 1/20 0.34
ABL2 P42684 1/20 0.34
PDE4D Q08499 1/20 0.34
BACE1 P56817 1/20 0.33

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
SCHEMBL3378478 0.83 DHFR (0.39) RAB9ASMN1; SMN2LMNAMAPTKMT2A
SCHEMBL3379679 0.82 DHFR (0.38) RAB9ASMN1; SMN2LMNAMAPTKMT2A
SCHEMBL3381911 0.82 RAB9A (0.39) RAB9ASMN1; SMN2LMNAMAPTKMT2A
SCHEMBL7928989 0.80 PIK3CD (0.38)
SCHEMBL7932127 0.80 DYRK3 (0.51) MAPTADORA2AADORA1PDE4DJAK2
SCHEMBL7930902 0.77 XPO1 (0.35) RAB9ASMN1; SMN2LMNAMAPTKMT2A
SCHEMBL7932092 0.76 KCNQ3 (0.45) KDRJAK2
SCHEMBL2919463 0.73 DHFR (0.39) KMT2ADHFRADORA2AADORA1PTPN11
SCHEMBL16044758 0.73 PDE4D (0.44) MAPTDHFRADORA2AADORA1KDR
SCHEMBL7911614 0.73 PDE4D (0.60) DHFRTDO2PDE4DFYN

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