SCHEMBL10908649

SCHEMBL10908649

CC(C)C(Oc1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 5/20 0.45
▸ RAB9A P51151 5/20 0.45
▸ ATM Q13315 1/20 0.43
▸ PKM P14618 2/20 0.42
▸ NFKB1 P19838 1/20 0.42
▸ NFKB2 Q00653 1/20 0.42
▸ RELA Q04206 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NPY5R Q15761 1/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ NR3C1 P04150 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.40
▸ LMNA P02545 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
SCHEMBL10786088 0.92 MEN1 (0.43) NPC1RAB9AATMPKMSMN1; SMN2
SCHEMBL11242054 0.92 NPC1 (0.44) NPC1RAB9AATMPKMNFKB1
SCHEMBL10786517 0.90 NPC1 (0.43) NPC1RAB9APKMSMN1; SMN2KMT2A
SCHEMBL8659039 0.89 NPC1 (0.47) NPC1RAB9AATMPKMNFKB1
SCHEMBL10786095 0.88 MEN1 (0.43) NPC1RAB9AATMPKMSMN1; SMN2
SCHEMBL11134228 0.86 MEN1 (0.42) NPC1RAB9AATMPKMSMN1; SMN2
SCHEMBL11235882 0.86 ATM (0.46) NPC1RAB9AATMPKMNFKB1
SCHEMBL10787482 0.86 MEN1 (0.44) NPC1RAB9APKMSMN1; SMN2KMT2A
SCHEMBL11390176 0.84 ATM (0.45) NPC1RAB9AATMPKMNFKB1
SCHEMBL10906940 0.83 NPC1 (0.44) NPC1RAB9AATMPKMNFKB1

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-4567295-A Composition active against mites, whitefly and thrips, pharmaceutical composition, and new benzoylurea compounds DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1986-01-28 — — US disclosed
EP-0116728-A1 Composition active against mites, whitefly and thrips, pharmaceutical composition, and new benzoylureau compounds DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1984-08-29 — — EP disclosed
US-4350706-A MITICIDES, LARVICIDES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1982-09-21 — — US disclosed
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