SCHEMBL10711075

SCHEMBL10711075

CCCN(C(=O)Nc1c(C)cc(NC(=O)NC(=O)c2c(F)cccc2F)cc1C)c1ccc(Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ TRPA1 O75762 2/20 0.40
▸ LIMK1 P53667 6/20 0.38
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ ROCK2 O75116 1/20 0.37
▸ CNR1 P21554 2/20 0.36
▸ PKM P14618 1/20 0.36
▸ GAA P10253 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ THRB P10828 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ MCHR1 Q99705 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL10704062 0.89 MEN1 (0.41) MEN1KMT2ATRPA1LIMK1NPC1
SCHEMBL10703856 0.88 NPC1 (0.43) MEN1KMT2ALIMK1NPC1RAB9A
SCHEMBL10714921 0.85 CNR1 (0.41) MEN1KMT2ANPC1RAB9AROCK2
SCHEMBL10704876 0.85 MEN1 (0.43) MEN1KMT2ATRPA1NPC1RAB9A
SCHEMBL10703512 0.84 MEN1 (0.44) MEN1KMT2ALIMK1NPC1RAB9A
SCHEMBL10707150 0.84 GCGR (0.48) MEN1KMT2ANPC1RAB9APKM
SCHEMBL10493505 0.83 MEN1 (0.44) MEN1KMT2ALIMK1NPC1RAB9A
SCHEMBL10706436 0.83 HDAC6 (0.46) MEN1KMT2ALIMK1NPC1RAB9A
SCHEMBL10703872 0.82 HDAC6 (0.43) MEN1KMT2ALIMK1NPC1RAB9A
SCHEMBL10710564 0.81 NPC1 (0.42) MEN1KMT2ATRPA1LIMK1NPC1

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-4710516-A Insecticidal and acaricidal composition comprising a benzoylurea compound DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1987-12-01 — — US disclosed
US-4665235-A INSECTICIDES, MITICIDES, ANTITUMOR AGENTS DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1987-05-12 — — US disclosed
EP-0116729-A2 Benzoylurea compounds and pesticidal compositions comprisingsame DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1984-08-29 — — EP disclosed
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