SCHEMBL7850871

SCHEMBL7850871

C=CCOC(=O)c1cc[nH]c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.51
SNCA P37840 1/20 0.48
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 2/20 0.45
TSHR P16473 1/20 0.45
KDM4E B2RXH2 2/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
RHOA P61586 1/20 0.39
MAPT P10636 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
POLB P06746 2/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.38
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL9212901 0.80 SIRT2 (0.40) CYP3A4ALDH1A1HPGDMEN1KMT2A
SCHEMBL175786 0.79 SNCA (0.67) CYP3A4SNCAALDH1A1HSD17B10TSHR
SCHEMBL671053 0.77 CA12 (0.53) CYP3A4ALDH1A1TSHRKDM4ETP53
SCHEMBL254063 0.75 CYP3A4 (0.59) CYP3A4SNCAALDH1A1HSD17B10TSHR
Hydrochloric Acid SCHEMBL27813064 0.75 CA12 (0.52) CYP3A4ALDH1A1TSHRKDM4ETP53
Benzene SCHEMBL28207781 0.74 CYP3A4 (0.69) CYP3A4SNCAALDH1A1HSD17B10TSHR
SCHEMBL28343462 0.74 CYP3A4 (0.69) CYP3A4SNCAALDH1A1HSD17B10TSHR
SCHEMBL17386391 0.74 SNCA (0.61) CYP3A4SNCAALDH1A1HSD17B10TSHR
SCHEMBL461801 0.74 SNCA (0.61) CYP3A4SNCAALDH1A1HSD17B10TSHR
SCHEMBL21007 0.74 CYP3A4 (0.69) CYP3A4SNCAALDH1A1HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5306443-A Dissolving monomer with metal containing oxidizing agent in sufficient solvent to prevent polymerization; removal of solvent NIPPON SODA CO., LTD. (JP) 1994-04-26 US claimed
CN-121136320-A Preparation method of graphene-based antistatic plastic and graphene-based antistatic plastic pipe 江苏吉庆管材集团有限公司 2025-12-16 CN disclosed
US-11712467-B2 Methods of rational nicotine hapten design and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2023-08-01 US disclosed
US-11712467-B2 Methods of rational nicotine hapten design and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2023-08-01 US disclosed
US-11712467-B2 Methods of rational nicotine hapten design and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2023-08-01 US disclosed
US-20220362375-A1 METHODS OF RATIONAL NICOTINE HAPTEN DESIGN AND USES THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-11-17 US disclosed
US-11357848-B2 Methods of rational nicotine hapten design and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2022-06-14 US disclosed
US-11357848-B2 Methods of rational nicotine hapten design and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2022-06-14 US disclosed
US-20180125969-A1 METHODS OF RATIONAL NICOTINE HAPTEN DESIGN AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2018-05-10 US disclosed
US-20180125969-A1 METHODS OF RATIONAL NICOTINE HAPTEN DESIGN AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2018-05-10 US disclosed
US-5869485-A Pyrrolo 2,3-d!pyrimidines and their use NOVARTIS FINANCE CORP. (US) 1999-02-09 US disclosed
EP-0783505-A1 PYRROLO[2,3-d]PYRIMIDINES AND THEIR USE Novartis AG (CH) 1997-07-16 EP disclosed
WO-1996010028-A1 PYRROLO[2,3-d]PYRIMIDINES AND THEIR USE NOVARTIS AG (CH) 1996-04-04 WO disclosed
EP-0332704-B1 PROCESS FOR PRODUCING CONDUCTIVE POLYMER FILM NIPPON SODA CO (JP) 1994-12-21 EP disclosed
US-5306443-A Dissolving monomer with metal containing oxidizing agent in sufficient solvent to prevent polymerization; removal of solvent NIPPON SODA CO., LTD. (JP) 1994-04-26 US disclosed
EP-0332704-A1 PROCESS FOR PRODUCING CONDUCTIVE POLYMER FILM NIPPON SODA CO., LTD. (JP) 1989-09-20 EP disclosed
US-4511575-A Antidiabetic pyrrolecarboxylic acids PFIZER INC. (US) 1985-04-16 US disclosed
US-4511576-A Antidiabetic pyrrolecarboxylic acids PFIZER INC. (US) 1985-04-16 US disclosed
US-4351843-A LOWERING BLOOD GLUCOSE PFIZER INC. (US) 1982-09-28 US disclosed
US-4282242-A HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1981-08-04 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 (4 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-20220362375-A1 METHODS OF RATIONAL NICOTINE HAPTEN DESIGN AND USES THEREOF NAPRT, CHRNG, CHRNB2 CYP3A4 251/4885SNCA 1879/4885ALDH1A1 655/4885
US-11712467-B2 Methods of rational nicotine hapten design and uses thereof NAPRT, CHRNG, CHRNB2 CYP3A4 251/4885SNCA 1879/4885ALDH1A1 655/4885
US-11357848-B2 Methods of rational nicotine hapten design and uses thereof NAPRT, CHRNG, CHRNB2 CYP3A4 251/4885SNCA 1879/4885ALDH1A1 655/4885
US-20180125969-A1 METHODS OF RATIONAL NICOTINE HAPTEN DESIGN AND USES THEREOF NAPRT, CHRNG, CHRNB2 CYP3A4 251/4885SNCA 1879/4885ALDH1A1 655/4885

“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.