SCHEMBL9737442

SCHEMBL9737442

O=C(NC(=O)c1ccccc1Br)Nc1ccc(Cl)c(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.57
EPHX2 P34913 2/20 0.57
CA2 P00918 1/20 0.56
CA4 P22748 1/20 0.56
CA5A P35218 1/20 0.56
CA9 Q16790 1/20 0.56
NPC1 O15118 7/20 0.56
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
RAB9A P51151 5/20 0.56
MAPT P10636 4/20 0.56
ALDH1A1 P00352 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
KDM4E B2RXH2 1/20 0.56
NFKB1 P19838 1/20 0.56
GFER P55789 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
MAPK14 Q16539 1/20 0.54
LMNA P02545 3/20 0.54

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
SCHEMBL13171396 0.88 PNLIP (0.64) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL9739800 0.87 GCGR (0.65) EPHX1EPHX2CA2CA4CA5A
SCHEMBL7604283 0.84 EPHX1 (0.58) EPHX1EPHX2CA2CA4CA5A
SCHEMBL30499695 0.84 EPHX1 (0.58) EPHX1EPHX2CA2CA4CA5A
SCHEMBL11430924 0.81 NPC1 (0.48) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL9501794 0.80 MEN1 (0.73) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL8840275 0.77 POLB (0.57) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL10353859 0.77 PNLIP (0.55) NPC1MEN1KMT2ARAB9AMAPT
SCHEMBL7191660 0.77 EPHX1 (0.64) EPHX1EPHX2CA2CA4CA5A
SCHEMBL30499685 0.77 EPHX1 (0.64) EPHX1EPHX2CA2CA4CA5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5142064-A Larvicides has benzoyl or thiobenzoyl group DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1992-08-25 US disclosed
US-4920135-A NONPHYTOTOXIC, INTERFERE WITH METAMORPHOSIS DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1990-04-24 US disclosed
US-4833151-A INTERFERES WITH METAMORPHOSES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1989-05-23 US disclosed
US-4607044-A Insecticidal use of ureas and thioureas DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1986-08-19 US disclosed
US-4166124-A IMIDAZOLE OR PYRIMIDINE RINGS U.S. PHILIPS CORPORATION (US) 1979-08-28 US disclosed
US-4110469-A Insecticidal N-(2,6-dichlorobenzoyl)-N'-(4-cyanophenyl) urea U.S. PHILIPS CORPORATION (US) 1978-08-29 US disclosed
US-4013717-A BENZOYL PHENYL UREA DERIVATIVES HAVING INSECTICIDAL ACTIVITIES U.S. PHILIPS CORPORATION (US) 1977-03-22 US disclosed
US-3989842-A Certain substituted benzoyl urea insecticides U.S. PHILIPS CORPORATION (US) 1976-11-02 US disclosed
US-3933908-A INSECTICIDE U.S. PHILIPS CORPORATION (US) 1976-01-20 US disclosed