SCHEMBL550320

SCHEMBL550320

CSCC(C)(C)NC(=O)c1ccccc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
NPSR1 Q6W5P4 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
APEX1 P27695 1/20 0.45
ALDH1A1 P00352 4/20 0.45
POLB P06746 2/20 0.44
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.43
KDM4E B2RXH2 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.39

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
Iodide SCHEMBL29459706 0.98 KMT2A (0.49) KMT2ANPSR1L3MBTL1APEX1ALDH1A1
SCHEMBL2964452 0.84 SMN1; SMN2 (0.51) KMT2ANPSR1L3MBTL1ALDH1A1POLB
SCHEMBL5427925 0.83 ALDH1A1 (0.50) ALDH1A1POLBHTTKDM4ECYP1A2
SCHEMBL13590979 0.82 NPSR1 (0.64) KMT2ANPSR1L3MBTL1APEX1ALDH1A1
SCHEMBL28474879 0.81 POLB (0.68) KMT2ANPSR1L3MBTL1APEX1ALDH1A1
SCHEMBL14612238 0.81 L3MBTL1 (0.40) KMT2ANPSR1L3MBTL1ALDH1A1POLB
SCHEMBL552006 0.80 NPSR1 (0.38) KMT2ANPSR1L3MBTL1ALDH1A1POLB
SCHEMBL552005 0.80 POLB (0.35) KMT2ANPSR1L3MBTL1ALDH1A1POLB
SCHEMBL550487 0.80 ALB (0.40) KMT2ANPSR1L3MBTL1POLBALOX15
SCHEMBL551672 0.80 PBRM1 (0.42) KMT2ANPSR1L3MBTL1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109485588-A A kind of synthetic method of fipronil bisamide 成都蓝蜻蜓生物技术有限公司 2019-03-19 CN claimed
CN-109020934-A The preparation method of intermediate containing halogenated benzene ring side chain fipronil bisamide structure 绍兴贝斯美化工股份有限公司 2018-12-18 CN claimed
CN-109020934-B Preparation method of intermediate containing halogenated benzene ring side chain flubendiamide structure 绍兴贝斯美化工股份有限公司 2022-03-08 CN disclosed
CN-109180543-A The preparation method of pesticide intermediate containing halogenated phenyl ring bisamide side-chain structure 绍兴贝斯美化工股份有限公司 2019-01-11 CN disclosed
EP-1698619-B1 PROCESS FOR PRODUCING 2-HALOGENOBENZAMIDE COMPOUND NIHON NOHYAKU CO LTD (JP) 2013-11-20 EP disclosed
CN-101198589-B N-benzanilides with insecticidal activity BAYER CROPSCIENCE AG 2012-07-18 CN disclosed
US-8110689-B2 Benzanilides with insecticidal activity BAYER CROPSCIENE AG (DE) 2012-02-07 US disclosed
US-7763750-B2 Process for producing 2-halogenobenzamide compound NIHON NOHYAKU CO., LTD. (JP) 2010-07-27 US disclosed
US-20100130743-A1 HETEROCYCLE-SUBSTITUTED, N-PHENYL-PHTHALAMIDE DERIVATIVES, RELATED COMPOUNDS AND THEIR USE AS INSECTICIDES BAYER CROPSCIENCE AG (DE) 2010-05-27 US disclosed
US-20100062937-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY BAYER CROPSCIENCE AG (DE) 2010-03-11 US disclosed
US-7674807-B2 Heterocycle-substituted n-phenyl-phthalamide derivatives, related compounds and their use as insecticides BAYER CROPSCIENCE AG (DE) 2010-03-09 US disclosed
EP-1727804-B1 N1 - ((PYRAZOL-1-YMETHYL) -2-METHYLPHENYL)- PHATALAMIDE DERIVATIVES AND RELATED COMPOUNDS INSECTICIDES BAYER CROPSCIENCE AG (DE) 2009-11-04 EP disclosed
CN-101198589-A N-benzanilides with insecticidal activity BAYER CROPSCIENCE AG (DE) 2008-06-11 CN disclosed
EP-1893567-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY Bayer CropScience AG (DE) 2008-03-05 EP disclosed
US-20070299085-A1 N1-((Pyrazol-1-Ymethyl)-2-Methylphenyl)-Phatalamide Derivatives And Related Compounds Insecticides BAYER CROPSCIENCE AG (DE) 2007-12-27 US disclosed
US-20070293701-A1 Process for Producing 2-Halogenobenzamide Compound NIHON NOHYAKU CO., LTD. (JP) 2007-12-20 US disclosed
WO-2006133823-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY BAYER CROPSCIENCE AG (DE) 2006-12-21 WO disclosed
EP-1698619-A1 PROCESS FOR PRODUCING 2-HALOGENOBENZAMIDE COMPOUND Nihon Nohyaku Co., Ltd. (JP) 2006-09-06 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100062937-A1 BENZANILIDES WITH INSECTICIDAL ACTIVITY CBR3, HCN3, HAX1 KMT2A 1629/4885NPSR1 1291/4885L3MBTL1 337/4885
US-20070293701-A1 Process for Producing 2-Halogenobenzamide Compound TYR, CBR3, TH KMT2A 286/4885NPSR1 2650/4885L3MBTL1 2171/4885
US-20100130743-A1 HETEROCYCLE-SUBSTITUTED, N-PHENYL-PHTHALAMIDE DERIVATIVES, RELATED COMPOUNDS AND THEIR USE AS INSECTICIDES DDT, SQOR, CYP2S1 KMT2A 765/4885NPSR1 687/4885L3MBTL1 361/4885
US-20070299085-A1 N1-((Pyrazol-1-Ymethyl)-2-Methylphenyl)-Phatalamide Derivatives And Related Compounds Insecticides CHRM1, KCNH1, DDT KMT2A 302/4885NPSR1 1470/4885L3MBTL1 518/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.