SCHEMBL4170309

SCHEMBL4170309

CCc1c(C(=O)O)ccc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.59
LDHA P00338 1/20 0.58
NR4A1 P22736 1/20 0.53
NR4A2 P43354 1/20 0.53
NR4A3 Q92570 1/20 0.53
NCEH1 Q6PIU2 1/20 0.51
GPR35 Q9HC97 2/20 0.50
POLB P06746 1/20 0.50
ALDH1A1 P00352 4/20 0.49
HPGD P15428 4/20 0.49
KDM4E B2RXH2 4/20 0.49
GLA P06280 2/20 0.49
GAA P10253 2/20 0.49
HSD17B10 Q99714 2/20 0.49
CDC25B P30305 1/20 0.47
LMNA P02545 1/20 0.44
CSNK2A2 P19784 1/20 0.44
CSNK2B P67870 1/20 0.44
CSNK2A1 P68400 1/20 0.44
CYP1A1 P04798 1/20 0.43

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
SCHEMBL4535161 0.86 NCEH1 (0.51) WDR5LDHANCEH1ALDH1A1HPGD
SCHEMBL29625682 0.85 WDR5 (0.63) WDR5LDHANR4A1NR4A2NR4A3
SCHEMBL23515379 0.85 WDR5 (0.63) WDR5LDHANR4A1NR4A2NR4A3
SCHEMBL3933696 0.85 GPR35 (0.46) WDR5LDHANR4A1NR4A2NR4A3
SCHEMBL11594011 0.84 NCEH1 (0.50) WDR5LDHANCEH1POLBALDH1A1
SCHEMBL25799004 0.84 NCEH1 (0.50) WDR5LDHANCEH1POLBALDH1A1
SCHEMBL10422778 0.84 WDR5 (0.61) WDR5LDHANR4A1NR4A2NR4A3
SCHEMBL14150812 0.83 NCEH1 (0.56) WDR5LDHANR4A1NR4A2NR4A3
SCHEMBL28150825 0.83 WDR5 (0.56) WDR5LDHANR4A1NR4A2NR4A3
SCHEMBL11115871 0.82 WDR5 (0.51) WDR5LDHANR4A1NR4A2NR4A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107019687-A The purposes of the naphthalenecarboxamide class compound of N (4 chlorphenyl) 3 hydroxyl 2 上海市伤骨科研究所 2017-08-08 CN disclosed
CN-102964224-B The alkoxyalkyl method of aromatic substrate DAVID PROCESS TECHNOLOGY LTD. (GB) 2016-05-04 CN disclosed
CN-102964224-A Process DAVY PROCESS TECHN LTD 2013-03-13 CN disclosed
CN-102958892-A Method for preparing chemical compounds of interest by aromatic nucleophilic substitution CENTRE NAT RECH SCIENT 2013-03-06 CN disclosed
US-20120316337-A1 METHOD FOR PREPARING CHEMICAL COMPOUNDS OF INTEREST BY NUCLEOPHILIC AROMATIC SUBSTITUTION OF AROMATIC CARBOXYLIC ACID DERIVATIVES SUPPORTING AT LEAST ONE ELECTRO-ATTRACTIVE GROUP UNIVERSITE DU MAINE (FR) 2012-12-13 US disclosed
US-20120316337-A1 METHOD FOR PREPARING CHEMICAL COMPOUNDS OF INTEREST BY NUCLEOPHILIC AROMATIC SUBSTITUTION OF AROMATIC CARBOXYLIC ACID DERIVATIVES SUPPORTING AT LEAST ONE ELECTRO-ATTRACTIVE GROUP UNIVERSITE DU MAINE (FR) 2012-12-13 US disclosed
US-20120316337-A1 METHOD FOR PREPARING CHEMICAL COMPOUNDS OF INTEREST BY NUCLEOPHILIC AROMATIC SUBSTITUTION OF AROMATIC CARBOXYLIC ACID DERIVATIVES SUPPORTING AT LEAST ONE ELECTRO-ATTRACTIVE GROUP UNIVERSITE DU MAINE (FR) 2012-12-13 US disclosed
CN-101203475-B Method of producing a composite material DAVY PROCESS TECHN LTD 2012-06-20 CN disclosed
CN-101560272-A Olefinic polymerization catalyst, preparation method and polymerization method YINGKOU XIANGYANG CATALYST CO (CN) 2009-10-21 CN disclosed
US-20090215978-A1 PROCESS DAVY PROCESS TECHNOLOGY LIMITED (GB) 2009-08-27 US disclosed
CN-101203475-A method DAVY PROCESS TECHN LTD (GB) 2008-06-18 CN disclosed
EP-1853540-A1 PROCESS Davy Process Technology Limited (GB) 2007-11-14 EP disclosed
WO-2006089900-A1 PROCESS DAVY PROCESS TECHNOLOGY LTD (GB) 2006-08-31 WO disclosed
US-4123219-A PHOTOCHEMICAL DIMERIZATION OF TWO NAPHTHALENE COMPOUNDS AND HEATING PRODUCT TO RELEASE ENERGY AS HEAT COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH (AU) 1978-10-31 US disclosed
US-3994675-A Chemical storage of radiant energy COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANIZATION (AU) 1976-11-30 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-20120316337-A1 METHOD FOR PREPARING CHEMICAL COMPOUNDS OF INTEREST BY NUCLEOPHILIC AROMATIC SUBSTITUTION OF AROMATIC CARBOXYLIC ACID DERIVATIVES SUPPORTING AT LEAST ONE ELECTRO-ATTRACTIVE GROUP COMT, NAA15, NUDC WDR5 3436/4885LDHA 2726/4885NR4A1 775/4885

“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.