SCHEMBL7981902

SCHEMBL7981902

Fc1ccccc1Nc1nc2ccccc2n2cncc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LCK P06239 18/20 1.00
LYN P07948 1/20 0.58
BTK Q06187 1/20 0.58
PIM1 P11309 1/20 0.57
CSNK2B P67870 1/20 0.57
CSNK2A1 P68400 1/20 0.57
PIM2 Q9P1W9 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
SCHEMBL7981113 0.87 LCK (0.77) LCKLYNBTK
SCHEMBL7980884 0.86 LCK (1.00) LCK
SCHEMBL7984726 0.84 LCK (0.72) LCKLYNBTK
SCHEMBL7979866 0.84 LCK (1.00) LCK
SCHEMBL7981437 0.82 LCK (0.69) LCKLYNBTK
SCHEMBL7980320 0.81 LCK (0.74) LCK
SCHEMBL7969592 0.81 LCK (0.83) LCK
SCHEMBL7969915 0.81 LCK (1.00) LCK
SCHEMBL7980299 0.81 LCK (0.75) LCKLYNBTK
SCHEMBL7969573 0.81 LCK (0.67) LCKLYNBTK

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