SCHEMBL11059310

SCHEMBL11059310

Cc1cccc(Cl)c1-n1cnc(NCCOCc2ccccc2)nc1=O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 14/20 0.44
MAPK14 Q16539 2/20 0.37
FGFR1 P11362 1/20 0.36
P2RX7 Q99572 1/20 0.35

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
SCHEMBL11055055 0.91 CHRNA7 (0.43) CHRNA7MAPK14FGFR1P2RX7
SCHEMBL11053517 0.90 TDP1 (0.38) CHRNA7MAPK14FGFR1P2RX7
SCHEMBL11056309 0.89 MEN1 (0.36) CHRNA7P2RX7
SCHEMBL11057686 0.88 MAOA (0.35) CHRNA7P2RX7
SCHEMBL11497315 0.87 MKNK1 (0.39) MAPK14FGFR1P2RX7
SCHEMBL11050220 0.86 SMN1; SMN2 (0.43) CHRNA7MAPK14FGFR1
SCHEMBL11057744 0.85 CHRNA7 (0.49) CHRNA7MAPK14FGFR1
SCHEMBL11055490 0.85 MAOA (0.38) P2RX7
SCHEMBL11050309 0.82 CHRNA7 (0.43) CHRNA7MAPK14FGFR1
SCHEMBL11059426 0.80 KMT2A (0.35) CHRNA7

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