SCHEMBL7979960

SCHEMBL7979960

Fc1cccc(Nc2nc3ccccc3n3cncc23)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LCK P06239 18/20 1.00
HCRTR1 O43613 1/20 0.67
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
MAPT P10636 1/20 0.56
KMT2A Q03164 1/20 0.56

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
SCHEMBL4931040 0.85 LCK (1.00) LCK
SCHEMBL7980320 0.85 LCK (0.74) LCK
SCHEMBL7969972 0.85 LCK (0.78) LCK
SCHEMBL7969765 0.84 LCK (0.73) LCKMAPT
SCHEMBL7969723 0.82 LCK (0.69) LCK
SCHEMBL7969675 0.82 LCK (0.69) LCKKMT2A
SCHEMBL7983035 0.82 LCK (0.73) LCK
SCHEMBL7969728 0.82 LCK (0.69) LCK
SCHEMBL7980715 0.82 LCK (0.69) LCK
SCHEMBL7981113 0.81 LCK (0.77) 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