SCHEMBL7765522

SCHEMBL7765522

CCCCCCCCCc1ccc2c(c1)Sc1cc(CCCCCCCCC)ccc1N2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.46
ESR1 P03372 2/20 0.46
ADRA2A P08913 2/20 0.46
ADORA3 P0DMS8 2/20 0.46
TACR2 P21452 2/20 0.46
SLC6A2 P23975 2/20 0.46
SLC6A4 P31645 2/20 0.46
SLC6A3 Q01959 2/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
SHBG P04278 1/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
HSPD1 P10809 1/20 0.46
ADRB3 P13945 1/20 0.46
HTR2C P28335 1/20 0.46
HSPE1 P61604 1/20 0.46
HIF1A Q16665 1/20 0.46
TST Q16762 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
SCHEMBL225844 1.00 PTGS2 (0.46) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL29640428 1.00 PTGS2 (0.46) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL29399785 1.00 PTGS2 (0.46) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL8142919 1.00 PTGS2 (0.46) PTGS2ESR1ADRA2AADORA3TACR2
SCHEMBL227244 0.93 SNCA (0.46) PTGS2ADORA3SLC6A2SLC6A3ALDH1A1
SCHEMBL29640461 0.93 SNCA (0.46) PTGS2ADORA3SLC6A2SLC6A3ALDH1A1
SCHEMBL8150371 0.92 NOX1 (0.50) PTGS2ADORA3SLC6A2SLC6A3LMNA
SCHEMBL8156091 0.92 NOX1 (0.50) PTGS2ADORA3SLC6A2SLC6A3LMNA
SCHEMBL223661 0.92 NOX1 (0.50) PTGS2ADORA3SLC6A2SLC6A3LMNA
SCHEMBL7771194 0.86 PTGS2 (0.46) PTGS2ESR1ADRA2AADORA3TACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6210536-B1 DISTILLATION OF ACRYLIC OR METHACRYLIC ACID OR ESTER IN PRESENCE OF POLYMERIZATION INHIBITOR COMPRISING N,N*-DINITROSO PHENYLENEDIAMINE COMPOUND, A HYDROQUINONE OR HYDROQUINONE MONOMETHYL ETHER, PHENYLENEDIAMINE COMPOUND, PHENOTHIAZINE UNIROYAL CHEMICAL COMPANY, INC. 2001-04-03 US claimed
EP-0522709-B1 Polymerization inhibitors for acrylic acids and esters UNIROYAL CHEM CO INC (US) 1996-08-21 EP claimed
EP-0522709-A2 Polymerization inhibitors for acrylic acids and esters UNIROYAL CHEMICAL COMPANY, Inc. (US) 1993-01-13 EP claimed
EP-0334500-B1 VINYL AROMATIC COMPOSITONS STABILIZED AGAINST POLYMERIZATION UNIROYAL CHEMICAL COMPANY, Inc. (US) 1991-06-26 EP claimed
US-4915873-A PHENOTHIAZINE AND ARYL-SUBSTITUTED PHENYLENEDIAMINE UNIROYAL CHEMICAL COMPANY, INC. (US) 1990-04-10 US claimed
EP-0334500-A1 Vinyl aromatic compositons stabilized against polymerization UNIROYAL CHEMICAL COMPANY, Inc. (US) 1989-09-27 EP claimed
EP-0325059-A2 Polymerization inhibitor composition for vinyl aromatic compounds UNIROYAL CHEMICAL COMPANY, Inc. (US) 1989-07-26 EP claimed
US-12180312-B2 Composition for the immediate termination of a free-radical polymerization and uses thereof SPECIALTY OPERATIONS FRANCE (FR) 2024-12-31 US disclosed
US-20220411542-A1 COMPOSITION FOR THE IMMEDIATE TERMINATION OF A FREE-RADICAL POLYMERIZATION AND USES THEREOF RHODIA OPERATIONS (FR) 2022-12-29 US disclosed
CN-114641507-A Compositions for immediate termination of free radical polymerization and uses thereof 罗地亚经营管理公司 2022-06-17 CN disclosed
CN-108368021-B Method for producing ethylenically unsaturated carboxylic acid tert-butyl esters 巴斯夫欧洲公司 2021-10-15 CN disclosed
CN-107531609-B Process for preparing tert-butyl esters of aliphatic carboxylic acids 巴斯夫欧洲公司 2021-03-05 CN disclosed
CN-107810204-B Composition for immediate termination of free radical polymerization 巴斯夫欧洲公司 2020-04-14 CN disclosed
US-6210536-B1 DISTILLATION OF ACRYLIC OR METHACRYLIC ACID OR ESTER IN PRESENCE OF POLYMERIZATION INHIBITOR COMPRISING N,N*-DINITROSO PHENYLENEDIAMINE COMPOUND, A HYDROQUINONE OR HYDROQUINONE MONOMETHYL ETHER, PHENYLENEDIAMINE COMPOUND, PHENOTHIAZINE UNIROYAL CHEMICAL COMPANY, INC. 2001-04-03 US disclosed
EP-0522709-B1 Polymerization inhibitors for acrylic acids and esters UNIROYAL CHEM CO INC (US) 1996-08-21 EP disclosed
EP-0522709-A2 Polymerization inhibitors for acrylic acids and esters UNIROYAL CHEMICAL COMPANY, Inc. (US) 1993-01-13 EP disclosed
EP-0334500-B1 VINYL AROMATIC COMPOSITONS STABILIZED AGAINST POLYMERIZATION UNIROYAL CHEMICAL COMPANY, Inc. (US) 1991-06-26 EP disclosed
US-4915873-A PHENOTHIAZINE AND ARYL-SUBSTITUTED PHENYLENEDIAMINE UNIROYAL CHEMICAL COMPANY, INC. (US) 1990-04-10 US disclosed
EP-0334500-A1 Vinyl aromatic compositons stabilized against polymerization UNIROYAL CHEMICAL COMPANY, Inc. (US) 1989-09-27 EP disclosed
EP-0325059-A2 Polymerization inhibitor composition for vinyl aromatic compounds UNIROYAL CHEMICAL COMPANY, Inc. (US) 1989-07-26 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-20220411542-A1 COMPOSITION FOR THE IMMEDIATE TERMINATION OF A FREE-RADICAL POLYMERIZATION AND USES THEREOF NOX4, GPX4, TXN PTGS2 208/4885ESR1 2376/4885ADRA2A 4148/4885
US-12180312-B2 Composition for the immediate termination of a free-radical polymerization and uses thereof NOX4, GPX4, TXN PTGS2 208/4885ESR1 2376/4885ADRA2A 4148/4885

“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.