SCHEMBL7969762

SCHEMBL7969762

Cc1cccc(Cl)c1-c1ncc2c(N)nc3cc(N)ccc3n12

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.46
PDE2A O00408 3/20 0.42
SRC P12931 4/20 0.39
FGFR1 P11362 3/20 0.39
ALDH1A1 P00352 1/20 0.38
PDE10A Q9Y233 1/20 0.38
TLR7 Q9NYK1 4/20 0.36
KDM4E B2RXH2 1/20 0.36
RAD52 P43351 1/20 0.36
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
ATM Q13315 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
SCHEMBL7983002 0.91 LCK (0.46) LCKPDE2ASRCFGFR1TLR7
SCHEMBL7981250 0.86 PDE2A (0.40) LCKPDE2ASRCFGFR1PDE10A
SCHEMBL7981389 0.84 FGFR1 (0.41) LCKPDE2ASRCFGFR1PDE10A
SCHEMBL7983693 0.84 LCK (0.43) LCKPDE2ASRCFGFR1TLR7
SCHEMBL7983712 0.82 PDE2A (0.39) LCKPDE2ASRCFGFR1PDE10A
SCHEMBL7981780 0.81 NPC1 (0.43) PDE2AFGFR1ALDH1A1KDM4EMEN1
SCHEMBL7982709 0.80 LCK (0.53) LCKPDE2AFGFR1
SCHEMBL7983558 0.80 LCK (0.39) LCKPDE2ASRCFGFR1TLR7
SCHEMBL7981128 0.78 LCK (0.54) LCKSRCFGFR1KMT2A
SCHEMBL7982930 0.78 LCK (0.51) LCKPDE2ASRCFGFR1KMT2A

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
US-6235740-B1 AUTOIMMUNE DISEASES; ANTIPROLIFERATION AGENTS BRISTOL-MYERS SQUIBB CO. 2001-05-22 US claimed
WO-1999009845-A1 IMIDAZOQUINOXALINE PROTEIN TYROSINE KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 1999-03-04 WO claimed
US-6235740-B1 AUTOIMMUNE DISEASES; ANTIPROLIFERATION AGENTS BRISTOL-MYERS SQUIBB CO. 2001-05-22 US disclosed