Dinitro Cresol

Dinitro Cresol

SCHEMBL2549698

Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1O.N.c1ccccc1

nearest known ligand 0.89

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 7/20 0.89
ALDH1A1 P00352 5/20 0.89
KMT2A Q03164 5/20 0.59
MEN1 O00255 4/20 0.59
MAPT P10636 4/20 0.59
MAPK1 P28482 3/20 0.59
HPGD P15428 3/20 0.59
KDM4E B2RXH2 3/20 0.59
TDP1 Q9NUW8 3/20 0.59
ALOX15 P16050 2/20 0.59
ALOX12 P18054 2/20 0.59
HSD17B10 Q99714 2/20 0.59
TTR P02766 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2C9 P11712 1/20 0.59
RECQL P46063 1/20 0.59
PMP22 Q01453 1/20 0.59
HIF1A Q16665 1/20 0.59
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49

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
Dinitro Cresol SCHEMBL1716451 0.98 GPR35 (0.93) GPR35ALDH1A1KMT2AMEN1MAPT
Dinitro Cresol SCHEMBL906844 0.96 GPR35 (0.96) GPR35ALDH1A1KMT2AMEN1MAPT
Dinitro Cresol SCHEMBL6859521 0.96 GPR35 (0.96) GPR35ALDH1A1KMT2AMEN1MAPT
Dinitro Cresol SCHEMBL406533 0.96 GPR35 (0.96) GPR35ALDH1A1KMT2AMEN1MAPT
Dinitro Cresol SCHEMBL5598346 0.95 GPR35 (0.93) GPR35ALDH1A1KMT2AMEN1MAPT
Dinitro Cresol SCHEMBL1802405 0.95 GPR35 (0.93) GPR35ALDH1A1KMT2AMEN1MAPT
Dinitro Cresol SCHEMBL29430312 0.94 GPR35 (1.00) GPR35ALDH1A1KMT2AMEN1MAPT
Dinitro Cresol SCHEMBL8873755 0.94 GPR35 (1.00) GPR35ALDH1A1KMT2AMEN1MAPT
Dinitro Cresol SCHEMBL20734 0.94 GPR35 (1.00) GPR35ALDH1A1KMT2AMEN1MAPT
Dinitro Cresol SCHEMBL711035 0.93 GPR35 (0.96) GPR35ALDH1A1KMT2AMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105123695-B Soft rot control agent and Disease-Control for Soft-Rotting method 石原产业株式会社 2018-03-06 CN disclosed
CN-105658060-B Herbicidal combinations 石原产业株式会社 2018-01-30 CN disclosed
CN-107072209-A Herbicidal composition 石原产业株式会社 2017-08-18 CN disclosed
CN-105246333-B Tobacco axillary bud growth inhibitor and method for inhibiting tobacco axillary bud growth SDS生物技术株式会社 2017-04-26 CN disclosed
CN-105377038-B Method for producing trans-bis(aminomethyl)cyclohexane, method for producing bis(isocyanatomethyl)cyclohexane, bis(isocyanatomethyl)cyclohexane, polyisocyanate composition, and polyurethane resin 石原产业株式会社 2017-03-22 CN disclosed
CN-103732069-B Herbicidal composition Ishihara Sangyo Kabushiki Kaisha Ltd. (JP) 2016-03-02 CN disclosed
CN-105123695-A Control agent for soft rot and control method for the same ISHIHARA SANGYO KAISHA 2015-12-09 CN disclosed
CN-103118539-B Soft rot control agent and soft rot control method Ishihara Sangyo Kabushiki Kaisha Ltd. (JP) 2015-09-16 CN disclosed
CN-102802422-B Agent for controlling soft rot and method for controlling the same ISHIHARA SANGYO KAISHA 2014-12-03 CN disclosed
CN-102164484-B Water-emulsifiable liquid active ingredient concentrates BASF SE (DE) 2014-10-15 CN disclosed
CN-103118539-A Soft rot control agent and soft rot control method ISHIHARA SANGYO KAISHA 2013-05-22 CN disclosed
CN-103068233-A Agrochemical mixtures for increasing the health of a plant BASF SE 2013-04-24 CN disclosed
EP-2552889-A1 FUNGICIDAL IMINODERIVATIVES BASF SE (DE) 2013-02-06 EP disclosed
US-20130029846-A1 Fungicidal Iminoderivatives BASF SE (DE) 2013-01-31 US disclosed
CN-102802422-A Agent for controlling soft rot and method for controlling the same ISHIHARA SANGYO KAISHA 2012-11-28 CN disclosed
WO-2011120912-A1 FUNGICIDAL IMINODERIVATIVES BASF SE (DE) 2011-10-06 WO disclosed
CN-102164484-A Water-emulsifiable liquid active ingredient concentrates BASF SE 2011-08-24 CN disclosed
CN-100444728-C Method for determining practical application amount of pest control agent, method for developing pest control agent, and method for expressing performance of pest control agent THINK CHEMICAL CO LTD (JP) 2008-12-24 CN disclosed
CN-101282648-A Water-suspendable agricultural chemical composition SYNGENTA PARTICIPATIONS AG (CH) 2008-10-08 CN disclosed
CN-1561161-A Method of determining the practically useful application dose of pesticide, method of developing pesticide and method of indicating the performance of pesticide THINK CHEMICAL CO LTD (JP) 2005-01-05 CN 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-20130029846-A1 Fungicidal Iminoderivatives CYP1B1, CYP1A1, CYP51A1 GPR35 4266/4885ALDH1A1 506/4885KMT2A 4153/4885

“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.