SCHEMBL11279353

SCHEMBL11279353

O=C=NC(=O)c1c(Br)cccc1Br

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.33
HPGD P15428 1/20 0.32
HSD11B1 P28845 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PRNP P04156 1/20 0.30

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
SCHEMBL11286353 0.87 ALDH1A1 (0.42) HPGDNPC1
SCHEMBL11274036 0.87 CES2 (0.44) HPGDNPC1RAB9A
SCHEMBL7753673 0.78 KMT2A (0.41) HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL11413326 0.75
SCHEMBL4141953 0.75 CES2 (0.52) NPC1RAB9A
SCHEMBL7754721 0.75 ALDH1A1 (0.50) HPGDNPC1
SCHEMBL10637292 0.75 L3MBTL1 (0.38) SLC9A1HPGDNPC1RAB9A
SCHEMBL28864381 0.71 PARP1 (0.53) HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL11006546 0.71 CA12 (0.55) HPGDSMN1; SMN2
SCHEMBL3395919 0.70 L3MBTL1 (0.43) HPGD

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
CN-116023335-A Benzoyl urea derivative and preparation method and application thereof 河北科技大学 2023-04-28 CN disclosed
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