SCHEMBL7983552

SCHEMBL7983552

Fc1ccc(CCNc2nc3ccccc3n3cncc23)cc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LCK P06239 18/20 0.67
KDM4E B2RXH2 1/20 0.51
HPGD P15428 1/20 0.51
PPARG P37231 1/20 0.51
NR2E3 Q9Y5X4 1/20 0.51
NCOR2 Q9Y618 1/20 0.51
MAPK8 P45983 1/20 0.50

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
SCHEMBL7983557 0.88 LCK (0.70) LCKMAPK8
SCHEMBL7983198 0.81 LCK (1.00) LCKMAPK8
SCHEMBL7969596 0.80 LCK (1.00) LCK
SCHEMBL7980293 0.79 LCK (0.66) LCKMAPK8
SCHEMBL7981369 0.77 LCK (0.61) LCKKDM4EHPGD
SCHEMBL7980641 0.77 LCK (0.67) LCKKDM4EHPGDMAPK8
SCHEMBL7969734 0.77 LCK (0.58) LCKKDM4EHPGDPPARGNR2E3
SCHEMBL7983684 0.77 LCK (0.83) LCK
SCHEMBL7981429 0.77 LCK (0.74) LCK
SCHEMBL7983608 0.76 LCK (0.81) 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