SCHEMBL1029396

SCHEMBL1029396

CC(C)Nc1ccc(N=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.52
HSD17B10 Q99714 5/20 0.52
TDP1 Q9NUW8 4/20 0.50
TSHR P16473 4/20 0.48
CYP3A4 P08684 3/20 0.48
THRB P10828 2/20 0.48
ALOX15 P16050 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
LMNA P02545 2/20 0.48
ALOX12 P18054 1/20 0.48
RECQL P46063 1/20 0.48
ATM Q13315 1/20 0.48
HTT P42858 1/20 0.48
RXFP1 Q9HBX9 1/20 0.44
TP53 P04637 2/20 0.41
HIF1A Q16665 2/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HSP90AA1 P07900 1/20 0.38

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
SCHEMBL5953329 0.87 ALDH1A1 (0.72) ALDH1A1HSD17B10TDP1TSHRCYP3A4
SCHEMBL27866639 0.83 ALDH1A1 (0.54) ALDH1A1HSD17B10TDP1TSHRCYP3A4
Hydrochloric Acid SCHEMBL11395642 0.81 ALDH1A1 (0.52) ALDH1A1HSD17B10TDP1TSHRCYP3A4
SCHEMBL39430 0.80 TDP1 (0.72) ALDH1A1HSD17B10TDP1TSHRCYP3A4
SCHEMBL1028447 0.78 ALDH1A1 (0.56) ALDH1A1HSD17B10TDP1TSHRCYP3A4
SCHEMBL9877223 0.78 ALDH1A1 (0.44) ALDH1A1HSD17B10TDP1TSHRCYP3A4
SCHEMBL9877687 0.78 ALDH1A1 (0.50) ALDH1A1HSD17B10TDP1TSHRCYP3A4
SCHEMBL638296 0.77 ALDH1A1 (0.44) ALDH1A1HSD17B10TDP1TSHRCYP3A4
SCHEMBL18893124 0.75 TDP1 (0.48) ALDH1A1HSD17B10TDP1TSHRCYP3A4
SCHEMBL8585221 0.74 TDP1 (0.64) ALDH1A1HSD17B10TDP1TSHRCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1474377-B1 NITROSOPHENOLS AND C-NITROSOANILINES AS POLYMERIZATION INHIBITORS CHEMTURA CORP (US) 2011-01-19 EP claimed
US-7125475-B2 Nitrosophenols and C-nitrosoanilines as polymerization inhibitors CROMPTON CORPORATION (US) 2006-10-24 US claimed
EP-1474377-A1 NITROSOPHENOLS AND C-NITROSOANILINES AS POLYMERIZATION INHIBITORS Crompton Corporation (US) 2004-11-10 EP claimed
WO-2003070687-A1 NITROSOPHENOLS AND C-NITROSOANILINES AS POLYMERIZATION INHIBITORS CROMPTON CORPORATION (US) 2003-08-28 WO claimed
US-20030155227-A1 Nitrosophenols and C-nitrosoanilines as polymerization inhibitors CROMPTON CORPORATION 2003-08-21 US claimed
CN-106999852-B Process for improved reactive monomer production 赢创德固赛有限公司 2019-12-06 CN disclosed
US-20180361319-A1 METHOD FOR IMPROVED REACTVE MONOMER PRODUCTION WITH MEMBRANE FILTRATION EVONIK DEGUSSA GMBH (DE) 2018-12-20 US disclosed
EP-3197596-B1 METHOD FOR IMPROVED REACTIVE MONOMER PRODUCTION WITH MEMBRANE FILTRATION EVONIK DEGUSSA GMBH (DE) 2018-11-07 EP disclosed
US-20170144984-A1 MODULATORS OF THE RELAXIN RECEPTOR 1 THE UNITED STATES OF AMERICA AS REPRESENTED BY SECRETARY DEPT OF HEALTH AND HUMAN SERVICE (US) 2017-05-25 US disclosed
EP-2993164-B1 Phenolic (thio) acetals as inhibitors of the polymerisation of olefinically unsaturated monomers EVONIK DEGUSSA GMBH (DE) 2017-02-15 EP disclosed
EP-2993164-A1 Phenolic (thio) acetals as inhibitors of the polymerisation of olefinically unsaturated monomers Evonik Degussa GmbH (DE) 2016-03-09 EP disclosed
EP-1474377-B1 NITROSOPHENOLS AND C-NITROSOANILINES AS POLYMERIZATION INHIBITORS CHEMTURA CORP (US) 2011-01-19 EP disclosed
CN-1013109-B Preparation method of N-monosubstituted p-phenylenediamine compound UNIROYAL CHEM CO INC (US) 1991-07-10 CN disclosed
US-5001171-A Process, modified rubbers and rubber compositions BRIDGESTONE/FIRESTONE, INC. (US) 1991-03-19 US disclosed
EP-0208456-B1 PROCESS FOR MAKING N-MONOSUBSTITUTED P-PHENYLENEDIAMINES UNIROYAL CHEMICAL COMPANY, Inc. (US) 1990-06-06 EP disclosed
EP-0319733-A2 Process, modified rubbers and rubber compositions THE FIRESTONE TIRE & RUBBER COMPANY (US) 1989-06-14 EP disclosed
US-4788229-A BLENDING MIXTURES OF UNCURED ELASTOMERS AND FILLERS CONTAINING ELASTOMER-FILLER LINKAGE PROMOTERS; TIRES; FRICTION RESISTANCE; REDUCED HYSTERESIS THE FIRESTONE TIRE & RUBBER COMPANY (US) 1988-11-29 US disclosed
CN-86107268-A The preparation method of the single substituted p-phenylenediamine compounds of N- 1988-05-04 CN disclosed
US-4723040-A REACTING P-NITROSO-N-MONO SUBSTITUTED ANILINE WITH PRIMARY OR SECONDARY ALCOHOL UNIROYAL CHEMICAL COMPANY, INC. (US) 1988-02-02 US disclosed
EP-0208456-A2 Process for making n-monosubstituted p-phenylenediamines UNIROYAL CHEMICAL COMPANY, Inc. (US) 1987-01-14 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 (2 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-20180361319-A1 METHOD FOR IMPROVED REACTVE MONOMER PRODUCTION WITH MEMBRANE FILTRATION PUF60, MAX, SAMM50 ALDH1A1 4013/4885HSD17B10 2120/4885TDP1 3775/4885
US-20170144984-A1 MODULATORS OF THE RELAXIN RECEPTOR 1 RXFP1, RXFP2, RXFP3 ALDH1A1 2561/4885HSD17B10 2635/4885TDP1 860/4885

“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.