SCHEMBL11272571

SCHEMBL11272571

O=C(NC(=O)c1ccccc1Br)Nc1cc(=O)n(-c2cccc(C(F)(F)F)c2)nc1Cl

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.48
▸ NPY5R Q15761 14/20 0.46
▸ MAPK14 Q16539 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ NPSR1 Q6W5P4 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
SCHEMBL11287046 0.85 MAPK14 (0.52) NPY5RMAPK14SMN1; SMN2MAPTMEN1
SCHEMBL11271650 0.83 RXFP1 (0.46) RXFP1NPY5RMAPK14SMN1; SMN2MAPT
SCHEMBL11286892 0.81 RXFP1 (0.48) RXFP1NPY5RSMN1; SMN2MAPT
SCHEMBL11283109 0.76 KMT2A (0.56) NPY5RSMN1; SMN2MAPTMEN1POLB
SCHEMBL11286418 0.76 RXFP1 (0.46) RXFP1NPY5RMAPK14SMN1; SMN2MAPT
SCHEMBL11273034 0.75 SMN1; SMN2 (0.41) RXFP1SMN1; SMN2MAPTPOLBGAA
SCHEMBL11281897 0.74 RXFP1 (0.48) RXFP1NPY5RMAPK14SMN1; SMN2MAPT
SCHEMBL11283145 0.73 MAPK14 (0.47) RXFP1NPY5RMAPK14SMN1; SMN2MAPT
SCHEMBL7748808 0.71 SMN1; SMN2 (0.52) RXFP1SMN1; SMN2GAA
SCHEMBL11270873 0.70 MAPK14 (0.46) NPY5RMAPK14MAPT

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 2 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
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