SCHEMBL7981250

SCHEMBL7981250

CNc1ccc2c(c1)nc(N)c1cnc(-c3c(C)cccc3Cl)n12

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 3/20 0.40
LCK P06239 9/20 0.37
SRC P12931 3/20 0.36
FGFR1 P11362 2/20 0.36
PDE10A Q9Y233 1/20 0.35
TLR7 Q9NYK1 3/20 0.34
WEE1 P30291 1/20 0.34
ABL1 P00519 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
SCHEMBL7983558 0.91 LCK (0.39) PDE2ALCKSRCFGFR1TLR7
SCHEMBL7983693 0.89 LCK (0.43) PDE2ALCKSRCFGFR1TLR7
SCHEMBL7983712 0.87 PDE2A (0.39) PDE2ALCKSRCFGFR1PDE10A
SCHEMBL7969762 0.86 LCK (0.46) PDE2ALCKSRCFGFR1PDE10A
SCHEMBL7981780 0.85 NPC1 (0.43) PDE2AFGFR1
SCHEMBL7982709 0.84 LCK (0.53) PDE2ALCKFGFR1WEE1
SCHEMBL7981128 0.83 LCK (0.54) LCKSRCFGFR1WEE1
SCHEMBL7982930 0.82 LCK (0.51) PDE2ALCKSRCFGFR1WEE1
SCHEMBL7983253 0.82 KDM4E (0.52)
SCHEMBL7983214 0.81 LCK (0.51) LCKSRCFGFR1WEE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6235740-B1 AUTOIMMUNE DISEASES; ANTIPROLIFERATION AGENTS BRISTOL-MYERS SQUIBB CO. 2001-05-22 US claimed
US-6235740-B1 AUTOIMMUNE DISEASES; ANTIPROLIFERATION AGENTS BRISTOL-MYERS SQUIBB CO. 2001-05-22 US disclosed