SCHEMBL7982041

SCHEMBL7982041

CCc1cccc(CC)c1Nc1nc2ccccc2n2cncc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LCK P06239 19/20 1.00
KMT2A Q03164 1/20 0.57

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
SCHEMBL7970113 0.93 LCK (0.87) LCKKMT2A
SCHEMBL7980767 0.83 LCK (1.00) LCK
SCHEMBL7982128 0.81 LCK (1.00) LCK
SCHEMBL7984724 0.81 LCK (1.00) LCK
SCHEMBL7980884 0.81 LCK (1.00) LCK
SCHEMBL7984163 0.81 LCK (0.67) LCK
SCHEMBL7983559 0.80 LCK (0.71) LCK
SCHEMBL7970006 0.80 LCK (0.78) LCK
SCHEMBL7969728 0.80 LCK (0.69) LCK
SCHEMBL7969485 0.79 LCK (1.00) 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