SCHEMBL8170937

SCHEMBL8170937

CCC=Cc1ccc(Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.51
AHR P35869 1/20 0.48
CYP1A2 P05177 1/20 0.45
PTGS2 P35354 2/20 0.44
ALOX5 P09917 1/20 0.44
PTGS1 P23219 1/20 0.44
HSD17B10 Q99714 1/20 0.42
FBP1 P09467 1/20 0.42
GRIK1 P39086 1/20 0.41
GRIK2 Q13002 1/20 0.41
GRIK3 Q13003 1/20 0.41
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
MAOB P27338 1/20 0.40
NFE2L2 Q16236 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
SCHEMBL257322 1.00 KCNH2 (0.51) KCNH2AHRCYP1A2PTGS2ALOX5
SCHEMBL27629497 0.82 KCNH2 (0.53) KCNH2AHRCYP1A2PTGS2ALOX5
SCHEMBL13824133 0.82 KCNH2 (0.53) KCNH2AHRCYP1A2PTGS2ALOX5
SCHEMBL27610241 0.79 KCNH2 (0.58) KCNH2AHRCYP1A2PTGS2ALOX5
SCHEMBL8442224 0.78 NFE2L2 (0.50) PTGS2ALOX5PTGS1FBP1GRIK1
SCHEMBL73286 0.78 AHR (0.50) KCNH2AHRCYP1A2PTGS2ALOX5
SCHEMBL5704309 0.78 NFE2L2 (0.50) PTGS2ALOX5PTGS1FBP1GRIK1
SCHEMBL73285 0.78 AHR (0.50) KCNH2AHRCYP1A2PTGS2ALOX5
SCHEMBL9497613 0.77 ALOX5 (0.35) KCNH2PTGS2ALOX5PTGS1MAOB
SCHEMBL6002839 0.77 HSD17B10 (0.44) KCNH2AHRCYP1A2PTGS2ALOX5

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115141073-A Preparation method of aromatic hydrocarbon dimer compound 五邑大学 2022-10-04 CN disclosed
CN-112299946-A Method for synthesizing 1, 2-disubstituted olefin by reacting terminal group olefin with sulfoxide 沅江华龙催化科技有限公司 2021-02-02 CN disclosed
CN-112299945-A Method for synthesizing alkyl olefin by coupling double-bond carbon-hydrogen bond and saturated carbon-hydrogen bond 沅江华龙催化科技有限公司 2021-02-02 CN disclosed
CN-103435513-B Method for preparing cis-1-methoxycarbonyl-2-substituted phenyl-3,3-dinitrile cyclopropane under catalysis of niobium pentachloride YICHUN JINYANG RARE METALS CO., LTD. (CN) 2014-10-22 CN disclosed
CN-103435513-A Method for preparing cis-1-methoxycarbonyl-2-substituted phenyl-3,3-dinitrile cyclopropane under catalysis of niobium pentachloride YICHUN JINYANG RARE METALS CO LTD 2013-12-11 CN disclosed
CN-100584823-C Malononitrile compounds and their use as pesticides SUMITOMO CHEMICAL CO 2010-01-27 CN disclosed
CN-100376549-C Malononitrile compounds and their use as pesticides SUMITOMO CHEMICAL CO (JP) 2008-03-26 CN disclosed
CN-101033200-A Malononitrile compounds and their use as pesticides SUMITOMO CHEMICAL CO (JP) 2007-09-12 CN disclosed
US-7223754-B2 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders DYNOGEN PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed
US-20070066597-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders DYNOGEN PHARMACEUTICALS, INC. (US) 2007-03-22 US disclosed
WO-1997001602-A1 METHOD OF PREPARING INORGANIC PIGMENT DISPERSIONS HENKEL CORPORATION (US) 1997-01-16 WO disclosed
US-5466838-A Catalytic reaction of olefin with oxygen in the presence of aldehyde SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-11-14 US disclosed
EP-0540009-B1 Process for producing epoxides SUMITOMO CHEMICAL CO (JP) 1995-08-30 EP disclosed
US-5367087-A Process for producing epoxide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-11-22 US disclosed
EP-0540009-A1 Process for producing epoxides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-05-05 EP disclosed
EP-0350069-B1 METHOD FOR OXIDIZING UNSATURATED AROMATIC COMPOUNDS NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1993-03-17 EP disclosed
EP-0497758-A1 FUNCTIONALIZED COPOLYMERS OF PARA-ALKYLSTYRENE/ISOOLEFIN PREPARED BY NUCLEOPHILIC SUBSTITUTION. EXXON CHEMICAL PATENTS INC (US) 1992-08-12 EP disclosed
US-4967009-A REACTING UNSATURATED AROMATIC COMPOUNDS WITH AROMATIC IODOSYL COMPOUNDS TO YIELD AROMATIC ALDEHYDES OR KETONES NIPPON PETROCHEMICALS CO., LTD. (JP) 1990-10-30 US disclosed
EP-0350069-A2 Method for oxidizing unsaturated aromatic compounds NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-01-10 EP disclosed
US-4140514-A HERBICIDES CHEVRON RESEARCH COMPANY (US) 1979-02-20 US 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 (1 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-20070066597-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I KCNH2 93/4885AHR 1572/4885CYP1A2 1206/4885

“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.