SCHEMBL7970140

SCHEMBL7970140

c1cnc2ccc(Nc3nc4ccccc4n4cncc34)cc2c1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LCK P06239 19/20 0.67
TGFBR1 P36897 1/20 0.46

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
SCHEMBL7980870 0.80 LCK (1.00) LCK
SCHEMBL7969769 0.80 LCK (0.84) LCK
SCHEMBL4931040 0.80 LCK (1.00) LCK
SCHEMBL7980320 0.80 LCK (0.74) LCK
SCHEMBL7981428 0.78 LCK (0.80) LCK
SCHEMBL7969645 0.78 LCK (0.84) LCK
SCHEMBL7970845 0.78 LCK (0.80) LCK
SCHEMBL7979960 0.77 LCK (1.00) LCK
SCHEMBL7980236 0.77 LCK (0.74) LCK
SCHEMBL7969972 0.77 LCK (0.78) 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