Dinitro Cresol

Dinitro Cresol

SCHEMBL1901668

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

nearest known ligand 0.68

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.68
GPR35 Q9HC97 4/20 0.68
TSHR P16473 3/20 0.50
CES2 O00748 3/20 0.48
CES1 P23141 2/20 0.48
MAPT P10636 5/20 0.46
KDM4E B2RXH2 3/20 0.46
HPGD P15428 3/20 0.46
MEN1 O00255 2/20 0.46
ALOX15 P16050 2/20 0.46
ALOX12 P18054 2/20 0.46
KMT2A Q03164 2/20 0.46
HSD17B10 Q99714 2/20 0.46
TTR P02766 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
MAPK1 P28482 1/20 0.46
RECQL P46063 1/20 0.46
PMP22 Q01453 1/20 0.46
HIF1A Q16665 1/20 0.46

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 SCHEMBL560751 0.89 GPR35 (0.71) ALDH1A1GPR35TSHRCES2CES1
Dinitro Cresol SCHEMBL10684761 0.89 GPR35 (0.71) ALDH1A1GPR35CES2CES1MAPT
Dinitro Cresol SCHEMBL1716451 0.85 GPR35 (0.93) ALDH1A1GPR35TSHRMAPTKDM4E
Dinitro Cresol SCHEMBL7991585 0.85 GPR35 (0.73) ALDH1A1GPR35TSHRMAPTKDM4E
Dinitro Cresol SCHEMBL1509581 0.84 GPR35 (0.78) ALDH1A1GPR35TSHRMAPTKDM4E
Dinitro Cresol SCHEMBL892354 0.84 ALDH1A1 (0.78) ALDH1A1GPR35TSHRCES2CES1
Dinitro Cresol SCHEMBL3976321 0.84 GPR35 (0.78) ALDH1A1GPR35TSHRMAPTKDM4E
Dinitro Cresol SCHEMBL2549698 0.84 GPR35 (0.89) ALDH1A1GPR35TSHRMAPTKDM4E
Dinitro Cresol SCHEMBL6859521 0.84 GPR35 (0.96) ALDH1A1GPR35TSHRMAPTKDM4E
Dinitro Cresol SCHEMBL9221013 0.83 ALDH1A1 (0.81) ALDH1A1GPR35TSHRMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1789473-A1 HIGH PURITY, HIGH MOLECULAR WEIGHT METHOXY-POLYETHYLENGLYCOLS (MPEG) Dow Gloval Technologies Inc. (US) 2007-05-30 EP claimed
WO-2006028745-A1 HIGH PURITY, HIGH MOLECULAR WEIGHT METHOXY-POLYETHYLENGLYCOLS (MPEG) DOW GLOBAL TECHNOLOGIES INC. (US) 2006-03-16 WO claimed
US-20060045866-A1 Novel high purity and high molecular weight mPEG alcohol compositions CHAPPELOW CHRIS 2006-03-02 US claimed
US-20110109855-A1 POLYAMIC ACID AND A POLYIMIDE OBTAINED BY REACTING A DIANHYDRIDE AND A DIAMINE SONY CORPORATION (JP) 2011-05-12 US disclosed