SCHEMBL11057744

SCHEMBL11057744

Cc1cccc(Cl)c1-n1cnc(NCc2ccccc2)nc1=O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 13/20 0.49
FGFR1 P11362 1/20 0.47
ATM Q13315 1/20 0.43
MAPK14 Q16539 2/20 0.42
MAPK11 Q15759 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
ABL1 P00519 1/20 0.40
LCK P06239 1/20 0.40

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
SCHEMBL11056787 0.92 LCK (0.43) CHRNA7FGFR1LCK
SCHEMBL11061665 0.87 KMT2A (0.41) CHRNA7FGFR1LCK
SCHEMBL11058286 0.87 EGFR (0.45) CHRNA7FGFR1
SCHEMBL11059310 0.85 CHRNA7 (0.44) CHRNA7FGFR1MAPK14
SCHEMBL11050309 0.85 CHRNA7 (0.43) CHRNA7FGFR1MAPK14
SCHEMBL11060182 0.85 CHRNA7 (0.43) CHRNA7FGFR1
SCHEMBL11055055 0.85 CHRNA7 (0.43) CHRNA7FGFR1MAPK14
SCHEMBL11054654 0.84 CHRNA7 (0.42) CHRNA7FGFR1
SCHEMBL11058225 0.83 EGFR (0.46) CHRNA7FGFR1ABL1
SCHEMBL11054604 0.83 CHRNA7 (0.47) CHRNA7FGFR1MAPK14

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-4452980-A DIARRHEA WILLIAM H. RORER, INC. (US) 1984-06-05 US disclosed
US-4246409-A ANTIDIARRHEAL AGENTS WILLIAM H. RORER, INC. (US) 1981-01-20 US disclosed
US-4225315-A Triazinones from amidinoureas WILLIAM H. RORER, INC. (US) 1980-09-30 US disclosed