SCHEMBL11058178

SCHEMBL11058178

Cc1cccc(Cl)c1-n1cnc(NC(C)C)nc1=O

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.45
CHRNA7 P36544 15/20 0.44
MAPK14 Q16539 2/20 0.39
WEE1 P30291 1/20 0.36
HCAR1 Q9BXC0 1/20 0.36

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
SCHEMBL11053098 0.91 HCAR1 (0.43) FGFR1CHRNA7HCAR1
SCHEMBL11054604 0.86 CHRNA7 (0.47) FGFR1CHRNA7MAPK14WEE1HCAR1
SCHEMBL11056462 0.85 HCAR1 (0.36) FGFR1CHRNA7MAPK14WEE1HCAR1
SCHEMBL11057830 0.85 CDK4 (0.41) FGFR1CHRNA7MAPK14HCAR1
SCHEMBL11054654 0.84 CHRNA7 (0.42) FGFR1CHRNA7WEE1HCAR1
SCHEMBL11058286 0.82 EGFR (0.45) FGFR1CHRNA7
SCHEMBL11057821 0.82 CHRNA7 (0.44) CHRNA7WEE1HCAR1
SCHEMBL11059379 0.81 MKNK1 (0.46) FGFR1CHRNA7MAPK14WEE1
SCHEMBL11060182 0.81 CHRNA7 (0.43) FGFR1CHRNA7WEE1HCAR1
SCHEMBL11050309 0.81 CHRNA7 (0.43) FGFR1CHRNA7MAPK14

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