SCHEMBL11270873

SCHEMBL11270873

O=C(NC(=O)c1c(Cl)cccc1Cl)Nc1cnn(-c2cccc(C(F)(F)F)c2)c(=O)c1Br

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.46
▸ NPBWR1 P48145 1/20 0.46
▸ MCHR1 Q99705 1/20 0.46
▸ CCR1 P32246 4/20 0.43
▸ PTGES O14684 1/20 0.43
▸ MAPT P10636 1/20 0.42
▸ NPY5R Q15761 8/20 0.42
▸ KDR P35968 1/20 0.41
▸ ITGB1 P05556 1/20 0.40
▸ ITGA4 P13612 1/20 0.40
▸ ITGB7 P26010 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
SCHEMBL11273156 0.91 MAPK14 (0.49) MAPK14NPBWR1MCHR1CCR1MAPT
SCHEMBL11286418 0.91 RXFP1 (0.46) MAPK14NPBWR1MCHR1CCR1MAPT
SCHEMBL11272082 0.90 NPY5R (0.45) MAPK14NPBWR1MCHR1CCR1PTGES
SCHEMBL11275261 0.88 TLR7 (0.51) PTGESMAPT
SCHEMBL11286892 0.85 RXFP1 (0.48) NPBWR1MCHR1CCR1MAPTNPY5R
SCHEMBL11276599 0.85 TLR7 (0.43) MAPK14NPBWR1MCHR1CCR1PTGES
SCHEMBL9135913 0.84 GAA (0.45) MAPK14NPBWR1MCHR1CCR1MAPT
SCHEMBL11275106 0.83 NPY5R (0.45) MAPK14NPBWR1MCHR1CCR1MAPT
SCHEMBL11283145 0.82 MAPK14 (0.47) MAPK14NPBWR1MCHR1CCR1MAPT
SCHEMBL11287046 0.81 MAPK14 (0.52) MAPK14MAPTNPY5RKDR

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
EP-0063413-A1 1-Benzoyl-3-(heterocyclic)ureas, compositions, and insecticidal method ELI LILLY AND COMPANY (US) 1982-10-27 — — EP claimed
US-4366155-A 1-Benzoyl-3-(6-oxopyridazinyl)ureas, compositions, and insecticidal method ELI LILLY AND COMPANY (US) 1982-12-28 — — US disclosed
EP-0063413-A1 1-Benzoyl-3-(heterocyclic)ureas, compositions, and insecticidal method ELI LILLY AND COMPANY (US) 1982-10-27 — — EP disclosed
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