SCHEMBL11276599

SCHEMBL11276599

O=C(NC(=O)c1c(Cl)cccc1Cl)Nc1cnn(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(=O)c1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 1/20 0.43
▸ NPBWR1 P48145 2/20 0.42
▸ MCHR1 Q99705 2/20 0.42
▸ MAPK14 Q16539 1/20 0.41
▸ MAPT P10636 3/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ PKM P14618 1/20 0.40
▸ PTGES O14684 1/20 0.40
▸ CCR1 P32246 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38

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
SCHEMBL11274203 0.94 TLR7 (0.52) TLR7NPBWR1MCHR1MAPTNPC1
SCHEMBL11273156 0.93 MAPK14 (0.49) NPBWR1MCHR1MAPK14MAPTKMT2A
SCHEMBL8669219 0.89 GAA (0.46) NPBWR1MCHR1MAPTNPSR1NPC1
SCHEMBL11273766 0.88 SMN1; SMN2 (0.47) MAPK14MAPTNPSR1NPC1RAB9A
SCHEMBL11275261 0.86 TLR7 (0.51) TLR7MAPTNPC1GAAKMT2A
SCHEMBL11270873 0.85 MAPK14 (0.46) NPBWR1MCHR1MAPK14MAPTPTGES
SCHEMBL11278901 0.84 HTT (0.46) MAPK14MAPTNPSR1NPC1RAB9A
SCHEMBL11273034 0.84 SMN1; SMN2 (0.41) NPBWR1MCHR1MAPTNPSR1NPC1
SCHEMBL11283145 0.84 MAPK14 (0.47) NPBWR1MCHR1MAPK14MAPTGAA
SCHEMBL11277938 0.83 PTGES (0.52) NPBWR1MAPTNPSR1NPC1RAB9A

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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