SCHEMBL7969765

SCHEMBL7969765

FC(F)(F)c1cccc(Nc2nc3ccccc3n3cncc23)c1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LCK P06239 17/20 0.73
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
ABCG2 Q9UNQ0 2/20 0.49
EGFR P00533 1/20 0.49

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
SCHEMBL7969723 0.88 LCK (0.69) LCKABCG2
SCHEMBL7979960 0.84 LCK (1.00) LCKMAPT
SCHEMBL7980715 0.83 LCK (0.69) LCK
SCHEMBL7979727 0.83 LCK (0.59) LCK
SCHEMBL4931040 0.82 LCK (1.00) LCK
SCHEMBL7969972 0.82 LCK (0.78) LCK
SCHEMBL7979977 0.81 LCK (0.68) LCKTP53
SCHEMBL7980320 0.80 LCK (0.74) LCK
SCHEMBL7983035 0.79 LCK (0.73) LCK
SCHEMBL7969728 0.79 LCK (0.69) LCK

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