SCHEMBL7753673

SCHEMBL7753673

O=C=NC(=O)c1ccccc1Br

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
HPGD P15428 3/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
ELANE P08246 1/20 0.39
ALDH1A1 P00352 4/20 0.38
TP53 P04637 1/20 0.38
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL3395153 0.85 ALDH1A1 (0.42) HPGDPOLBNPC1SMN1; SMN2ALDH1A1
SCHEMBL5824686 0.82 ALDH1A1 (0.40) KMT2AHPGDMEN1POLBNPC1
SCHEMBL895013 0.78 KDM4E (0.52) KMT2AHPGDMEN1NPC1RAB9A
SCHEMBL11279353 0.78 SLC9A1 (0.33) HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL13739757 0.77 KMT2A (0.44) KMT2AHPGDMEN1POLBNPC1
SCHEMBL4145212 0.76 CES2 (0.54) KMT2AHPGDMEN1NPC1RAB9A
SCHEMBL2844572 0.76 CES2 (0.54) KMT2AHPGDMEN1POLBNPC1
SCHEMBL4936719 0.76 ERCC5 (0.46) KMT2AHPGDPOLBNPC1RAB9A
SCHEMBL11082801 0.76 MEN1 (0.43) KMT2AHPGDMEN1SMN1; SMN2ALDH1A1
SCHEMBL7238060 0.75 ALDH1A1 (0.47) KMT2AHPGDMEN1POLBNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912502-B1 2-CHLORO-3,5-BIS(TRIFLUOROMETHYL)PHENYL BENZOYL UREA DERIVATIVE AND PROCESS FOR PREPARING THE SAME DONGBU HANNONG CHEMICAL CO LTD (KR) 2001-01-17 EP disclosed
US-6051737-A AS PESTICIDE DONGBU HANNONG CHEMICAL, CO. LTD. (KR) 2000-04-18 US disclosed
US-6022882-A POTENT GROWTH-RETARDING ACTIVITY AGAINST PESTS DONGBU HANNONG CHEMICAL CO., LTD. (KR) 2000-02-08 US disclosed
EP-0939753-A1 ARYL BENZOYL UREA DERIVATIVE AND PESTICIDAL COMPOSITION COMPRISING THE SAME Dongbu Hannong Chemical Co., Ltd. (KR) 1999-09-08 EP disclosed
EP-0912502-A1 2-CHLORO-3,5-BIS(TRIFLUOROMETHYL)PHENYL BENZOYL UREA DERIVATIVE AND PROCESS FOR PREPARING THE SAME Hanwha Corporation (KR) 1999-05-06 EP disclosed
WO-1998000394-A1 2-CHLORO-3,5-BIS(TRIFLUOROMETHYL)PHENYL BENZOYL UREA DERIVATIVE AND PROCESS FOR PREPARING THE SAME HANWHA CORPORATION (KR) 1998-01-08 WO disclosed
WO-1997024321-A1 ARYL BENZOYL UREA DERIVATIVE AND PESTICIDAL COMPOSITION COMPRISING THE SAME HANWHA CORPORATION (KR) 1997-07-10 WO disclosed
WO-1995033711-A1 PHENYL BENZOYL(NICOTINOYL) UREA DERIVATIVES HANWHA CORPORATION (KR) 1995-12-14 WO disclosed
US-4508722-A 1-Benzoyl-3-(arylpyridyl)urea compounds ELI LILLY AND COMPANY (US) 1985-04-02 US disclosed
US-4405552-A INSECTICIDES ELI LILLY AND COMPANY (US) 1983-09-20 US 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
EP-0060071-A1 Improvements in or relating to 1-benzoyl-3-(arylpyridyl)urea compounds ELI LILLY AND COMPANY (US) 1982-09-15 EP disclosed
US-4293552-A Novel 1-(mono-o-substituted benzoyl)-3-(substituted pyrazinyl) ureas ELI LILLY AND COMPANY (US) 1981-10-06 US disclosed
EP-0009762-B1 SUBSTITUTED N-BENZOYL-N'-TERT.-ALCOXYCARBONYLPHENYL(THIO)UREAS, METHODS FOR THEIR PREPARATION AND THEIR USE AS INSECTICIDES BAYER AG (DE) 1981-08-05 EP disclosed
US-4234600-A Combating arthropods with N-benzoyl-N'-tert.-alkoxycarbonylphenyl-(thio) ureas BAYER AKTIENGESELLSCHAFT (DE) 1980-11-18 US disclosed
EP-0009762-A1 Substituted N-benzoyl-N'-tert.-alcoxycarbonylphenyl(thio)ureas, methods for their preparation and their use as insecticides BAYER AG (DE) 1980-04-16 EP disclosed