SCHEMBL981336

SCHEMBL981336

CCCCCc1ccccc1N

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.55
TLR8 Q9NR97 7/20 0.50
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
NR1H2 P55055 1/20 0.45
NR1H3 Q13133 1/20 0.45
ALOX5 P09917 1/20 0.44
PTGS2 P35354 1/20 0.44
BID P55957 3/20 0.42
MCL1 Q07820 3/20 0.42
BCL2L1 Q07817 2/20 0.42
BAK1 Q16611 2/20 0.42
KAT8 Q9H7Z6 2/20 0.42
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
EP300 Q09472 1/20 0.42
KAT2A Q92830 1/20 0.42
KAT2B Q92831 1/20 0.42
KAT5 Q92993 1/20 0.42

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
SCHEMBL983151 0.98 LIPG (0.58) LIPGTLR8CYP1A2CYP2C9CYP2C19
SCHEMBL932540 0.98 LIPG (0.58) LIPGTLR8CYP1A2CYP2C9CYP2C19
SCHEMBL2230507 0.98 LIPG (0.58) LIPGTLR8CYP1A2CYP2C9CYP2C19
SCHEMBL634079 0.98 LIPG (0.58) LIPGTLR8CYP1A2CYP2C9CYP2C19
SCHEMBL985061 0.98 LIPG (0.58) LIPGTLR8CYP1A2CYP2C9CYP2C19
SCHEMBL4069404 0.98 LIPG (0.58) LIPGTLR8CYP1A2CYP2C9CYP2C19
SCHEMBL4431698 0.98 LIPG (0.58) LIPGTLR8CYP1A2CYP2C9CYP2C19
SCHEMBL177297 0.98 LIPG (0.58) LIPGTLR8CYP1A2CYP2C9CYP2C19
SCHEMBL984903 0.98 LIPG (0.58) LIPGTLR8CYP1A2CYP2C9CYP2C19
SCHEMBL634069 0.98 LIPG (0.58) LIPGTLR8CYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114276286-A Method for preparing N, N-disubstituted-alpha, beta-unsaturated enamine from arone and secondary nitrogen compound 长沙资材科技有限公司 2022-04-05 CN claimed
EP-3368643-A2 LUBRICATING OIL COMPOSITIONS CONTAINING AMIDINE ANTIOXIDANTS Chevron Oronite Company LLC (US) 2018-09-05 EP claimed
US-20170121625-A1 LUBRICATING OIL COMPOSITIONS CONTAINING AMIDINE ANTIOXIDANTS CHEVRON ORONITE COMPANY LLC 2017-05-04 US claimed
US-20100004454-A1 QUINOLINIUM ION DERIVATIVES, PROCESS FOR THE PRODUCTION OF THE DERIVATIVES, PRODUCTS MADE BY USING THE SAME, AND REDUCTION AND OXIDATION METHODS WITH THE DERIVATIVES OSAKA UNIVERSITY (JP) 2010-01-07 US claimed
EP-1797163-A2 METHOD FOR REDUCING THE FREEZING POINT OF AMINATED AVIATION GASOLINE BY THE USE OF TERTIARYAMYLPHENYLAMINE EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2007-06-20 EP claimed
WO-2006026657-A2 METHOD FOR REDUCING THE FREEZING POINT OF AMINATED AVIATION GASOLINE BY THE USE OF TERTIARYAMYLPHENYLAMINE EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2006-03-09 WO claimed
EP-1528062-A2 Process for the preparation of s-type 4-substituted hydroxypyranoindolidine compounds TANABE SEIYAKU CO., LTD. (JP) 2005-05-04 EP claimed
US-20030135049-A1 S type 2-substituted hydroxy-2-indolidinylbutyric ester compounds and process for preparation thereof TANABE SEIYAKU CO., LTD. 2003-07-17 US claimed
US-20020161231-A1 Stype 2-substituted hydroxy-2-indolidinylbutyric ester compounds and process for preparation thereof TANABE SEIYAKU CO., LTD. 2002-10-31 US claimed
EP-1236728-A2 S-type 2-substituted hydroxy-2-indolinylbutyric ester compounds and process for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 2002-09-04 EP claimed
US-6015901-A INTERMEDIATES FOR ANTITUMOR AGENTS TANABE SEIYAKU CO., LTD. (JP) 2000-01-18 US claimed
EP-0845464-A2 S type 2-substituted hydroxy-2-indolidinylbutyric ester compounds as intermediates for camptothecin derivatives TANABE SEIYAKU CO., LTD. (JP) 1998-06-03 EP claimed
EP-0325247-B1 CAMPTOTHECIN DERIVATIVES AND PROCESS FOR PREPARING SAME KABUSHIKI KAISHA YAKULT HONSHA (JP) 1993-05-19 EP claimed
EP-0325247-A1 Camptothecin derivatives and process for preparing same KABUSHIKI KAISHA YAKULT HONSHA (JP) 1989-07-26 EP claimed
EP-0002309-B1 ACYLANILIDES, PROCESS FOR THEIR MANUFACTURE AND PHARMACEUTICAL AND VETERINARY COMPOSITIONS CONTAINING THEM IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-12-01 EP claimed
JP-1186892-A None JP disclosed
JP-57200337-A None JP disclosed
JP-S57200337-A NOVEL 2-ACYLANILINE DERIVATIVE ISHIKAWA MASAYUKI 1982-12-08 JP disclosed
US-4046554-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1977-09-06 US disclosed
US-3966811-A HERBICIDES VELSICOL CHEMICAL CORPORATION (US) 1976-06-29 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 (3 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-20020161231-A1 Stype 2-substituted hydroxy-2-indolidinylbutyric ester compounds and process for preparation thereof TOP2B, TOP2A, SI LIPG 4206/4885TLR8 1480/4885CYP1A2 304/4885
US-20030135049-A1 S type 2-substituted hydroxy-2-indolidinylbutyric ester compounds and process for preparation thereof TOP2B, TOP2A, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 LIPG 3770/4885TLR8 2581/4885CYP1A2 150/4885
US-20100004454-A1 QUINOLINIUM ION DERIVATIVES, PROCESS FOR THE PRODUCTION OF THE DERIVATIVES, PRODUCTS MADE BY USING THE SAME, AND REDUCTION AND OXIDATION METHODS WITH THE DERIVATIVES APEX1, NQO1, POT1 LIPG 4317/4885TLR8 4312/4885CYP1A2 2589/4885

“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.