SCHEMBL9706772

SCHEMBL9706772

O=C(NC(=O)N(Oc1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.46
PGR P06401 1/20 0.45
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 3/20 0.42
NPC1 O15118 4/20 0.41
RAB9A P51151 4/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HDAC8 Q9BY41 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.40
HDAC3 O15379 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
IDO1 P14902 1/20 0.40
ALOX15 P16050 1/20 0.40
HDAC1 Q13547 1/20 0.40
CA9 Q16790 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
SCHEMBL11016513 0.80 RAB9A (0.46) TDP1L3MBTL1ALDH1A1NPC1RAB9A
SCHEMBL11574977 0.77 NPC1 (0.50) TDP1ALDH1A1NPC1RAB9AKMT2A
SCHEMBL27521078 0.75 L3MBTL1 (0.55) EPHX1TDP1L3MBTL1ALDH1A1NPC1
SCHEMBL4963232 0.75 TDP1 (0.46) TDP1L3MBTL1ALDH1A1NPC1RAB9A
SCHEMBL10784052 0.75 ATM (0.48) TDP1L3MBTL1ALDH1A1NPC1RAB9A
SCHEMBL622873 0.73 ATM (0.47) TDP1L3MBTL1ALDH1A1NPC1RAB9A
SCHEMBL2913044 0.73 TDP1 (0.47) EPHX1TDP1L3MBTL1ALDH1A1NPC1
SCHEMBL10626822 0.73 TDP1 (0.47) EPHX1TDP1L3MBTL1ALDH1A1NPC1
SCHEMBL3826087 0.72 TDP1 (0.46) TDP1L3MBTL1ALDH1A1KMT2AMEN1
SCHEMBL622872 0.72 TDP1 (0.46) TDP1L3MBTL1ALDH1A1NPC1RAB9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992012707-A1 A BENZOYLUREA-CONTAINING COMPOSITION FOR PARASITE CONTROL IN ANIMALS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-08-06 WO disclosed
US-4897486-A INSECTICIDES, MITICIDES, LARVICIDES CIBA-GEIGY CORPORATION (US) 1990-01-30 US disclosed
US-4687855-A PESTICIDES; CIBA-GEIGY CORPORATION (US) 1987-08-18 US disclosed
US-4677127-A Certain N-3-(3-chloro-5-trifluoromethyl-pyridyl-2-oxy)-4-phenyl-N'-2,6-difluorobenzoyl ureas, pesticidal compositions and methods of use CIBA-GEIGY CORPORATION (US) 1987-06-30 US disclosed
US-4418066-A PESTICIDES CIBA-GEIGY CORPORATION (US) 1983-11-29 US disclosed