SCHEMBL784987

SCHEMBL784987

CNc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.78
ALDH1A1 P00352 9/20 0.72
HSD17B10 Q99714 6/20 0.72
ALOX12 P18054 4/20 0.72
L3MBTL1 Q9Y468 3/20 0.72
TDP1 Q9NUW8 3/20 0.72
ALOX15 P16050 3/20 0.72
MAPK1 P28482 2/20 0.72
PTGS1 P23219 1/20 0.72
SLC6A2 P23975 1/20 0.72
PTGS2 P35354 1/20 0.72
HTR2B P41595 1/20 0.72
HPGD P15428 2/20 0.64
MAPT P10636 8/20 0.56
CYP3A4 P08684 5/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C9 P11712 2/20 0.56
CYP2C19 P33261 2/20 0.56
HTT P42858 2/20 0.56
LMNA P02545 1/20 0.56

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
SCHEMBL13644735 1.00 TSHR (0.78) TSHRALDH1A1HSD17B10ALOX12L3MBTL1
SCHEMBL17283461 1.00 TSHR (0.78) TSHRALDH1A1HSD17B10ALOX12L3MBTL1
SCHEMBL16182026 0.93 TSHR (0.67) TSHRALDH1A1HSD17B10ALOX12L3MBTL1
SCHEMBL7338618 0.88 TSHR (0.56) TSHRALDH1A1HSD17B10ALOX12L3MBTL1
SCHEMBL19298582 0.88 TSHR (1.00) TSHRALDH1A1HSD17B10ALOX12L3MBTL1
SCHEMBL3008675 0.88
SCHEMBL4454 0.88
Benzene SCHEMBL17977991 0.88 TSHR (1.00) TSHRALDH1A1HSD17B10ALOX12L3MBTL1
SCHEMBL11220257 0.85 TSHR (0.93) TSHRALDH1A1HSD17B10ALOX12L3MBTL1
SCHEMBL4675612 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1976821-B1 DIRECT ALKYLATION OF N-ALKYL-N'-PHENYL-P-PHENYLENEDIAMINE CHEMTURA CORP (US) 2011-05-25 EP claimed
EP-1976821-A1 DIRECT ALKYLATION OF N-ALKYL-N'-PHENYL-P-PHENYLENEDIAMINE CHEMTURA CORPORATION (US) 2008-10-08 EP claimed
US-7361788-B2 Direct alkylation of N-alkyl-N′-phenyl-p-phenylenediamine CHEMTURA CORPORATION (US) 2008-04-22 US claimed
WO-2007087195-A1 DIRECT ALKYLATION OF N-ALKYL-N'-PHENYL-P-PHENYLENEDIAMINE CHEMTURA CORPORATION (US) 2007-08-02 WO claimed
US-20070173668-A1 Direct alkylation of N-alkyl-N'-phenyl-p-phenylenediamine LANXESS SOLUTIONS US INC. 2007-07-26 US claimed
EP-1056711-B1 PROCESS FOR STABILISING (METHA)ACRYLIC ESTERS AGAINST UNWANTED RADICAL POLYMERISATION BASF AG (DE) 2004-10-06 EP claimed
EP-1288189-A2 Alkylation of an aromatic amine,in particular diphenylamine, with polyisobutylene oligomers Chevron Oronite Company LLC (US) 2003-03-05 EP claimed
US-6355839-B1 ONE STEP REACTION OF POLYISOBUTYLENE WITH DIPHENYLAMINE CHEVRON U.S.A., INC. 2002-03-12 US claimed
JP-6298709-A None JP disclosed
CN-112602014-B Method for producing liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2025-02-11 CN disclosed
CN-112639595-B Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element 日产化学株式会社 2025-01-10 CN disclosed
CN-113272729-B Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element 日产化学株式会社 2024-08-20 CN disclosed
CN-113316742-B Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal display element, and novel monomer 日产化学株式会社 2024-08-16 CN disclosed
CN-118235084-A Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element 日产化学株式会社 2024-06-21 CN disclosed
EP-0041915-A1 Styrylated amine antioxidants THE GOODYEAR TIRE & RUBBER COMPANY (US) 1981-12-16 EP disclosed
US-4087619-A Amine containing antioxidants THE GOODYEAR TIRE & RUBBER COMPANY (US) 1978-05-02 US disclosed
US-4079091-A DIELS-ALDER REACTION WITH A P-PHENYLENEDIAMINE AS POLYCYCLIC BY-PRODUCT INHIBITOR NIPPON OIL CO., LTD. (JA) 1978-03-14 US disclosed
US-4051067-A Stabilization of unsaturated carboxylic acid esters with mixtures of polyalkyleneamines and arylenediamines MONSANTO COMPANY (US) 1977-09-27 US disclosed
US-4016198-A Stabilization of unsaturated carboxylic acid esters with mixtures of polyalkylene-amines and arylenediamines MONSANTO COMPANY (US) 1977-04-05 US disclosed
US-3979436-A ACRYLIC ESTERS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1976-09-07 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-20070173668-A1 Direct alkylation of N-alkyl-N'-phenyl-p-phenylenediamine PNMT, AAAS, PNN TSHR 4484/4885ALDH1A1 663/4885HSD17B10 2077/4885

“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.