SCHEMBL741007

SCHEMBL741007

CC(C)c1ccc(N)c(N)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.64
GAA P10253 2/20 0.64
HTT P42858 2/20 0.64
ALOX12 P18054 1/20 0.64
HIF1A Q16665 1/20 0.64
TDP1 Q9NUW8 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ALOX15 P16050 3/20 0.46
CYP3A4 P08684 2/20 0.46
TP53 P04637 2/20 0.46
THRB P10828 1/20 0.46
LMNA P02545 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TRPA1 O75762 1/20 0.43
PTGS1 P23219 1/20 0.43
CACNA1C Q13936 1/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SCN4A P35499 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
SCHEMBL29549360 1.00 ALDH1A1 (0.64) ALDH1A1GAAHTTALOX12HIF1A
SCHEMBL1599239 0.84 ALDH1A1 (0.46) ALDH1A1GAAHTTALOX12HIF1A
SCHEMBL29901014 0.82 ALDH1A1 (0.56) ALDH1A1GAAHTTALOX12HIF1A
SCHEMBL20681899 0.81 TDP1 (0.61) ALDH1A1GAAHTTALOX12HIF1A
SCHEMBL8976134 0.81 ALDH1A1 (0.45) ALDH1A1GAAHTTALOX12HIF1A
Hydrochloric Acid SCHEMBL29900995 0.80 ALDH1A1 (0.54) ALDH1A1GAAHTTALOX12HIF1A
SCHEMBL6033966 0.80 ALDH1A1 (0.54) ALDH1A1GAAHTTALOX12HIF1A
SCHEMBL2199068 0.80 ALDH1A1 (0.54) ALDH1A1GAAHTTALOX12HIF1A
SCHEMBL18422677 0.80 ALDH1A1 (0.48) ALDH1A1GAAHTTALOX12HIF1A
SCHEMBL17493709 0.80 ALDH1A1 (0.43) ALDH1A1GAAHTTALOX12HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6673872-B2 BLEND OF POLYIMIDE THERMOPLASTIC AND LOW VISCOSITY POLY(ARYLENE) ETHER GENERAL ELECTRIC COMPANY 2004-01-06 US claimed
US-5756643-A EXHIBITS HIGH SELECTIVITY FOR SEPARATION OF AN AROMATIC/SATURATE MIXTURE EXXON RESEARCH AND ENGINEERING COMPANY (US) 1998-05-26 US claimed
US-5670052-A CROSSLINKED MEMBRANE EXXON RESEARCH & ENGINEERING COMPANY (US) 1997-09-23 US claimed
US-5550199-A MEMBRANES EXXON RESEARCH AND ENGINEERING COMPANY (US) 1996-08-27 US claimed
US-5389441-A Phthalonitrile prepolymer as high temperature sizing material for composite fibers THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1995-02-14 US claimed
US-5132396-A Phthalonitrile monomers containing imide and/or phenoxy linkages, and polymers thereof THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1992-07-21 US claimed
US-11912825-B2 Polymers derived from 2,2′-bisimidazoles THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2024-02-27 US disclosed
US-11912825-B2 Polymers derived from 2,2′-bisimidazoles THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ALABAMA (US) 2024-02-27 US disclosed
US-11883387-B2 PqsR inverse agonists Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2024-01-30 US disclosed
US-11873389-B2 Composition and molded article AKITA UNIVERSITY (JP) 2024-01-16 US disclosed
CN-108689942-B Nitrogen-containing bicyclic compound, and preparation method and application thereof 广东东阳光药业有限公司 2023-06-09 CN disclosed
CN-115961470-A Mildew-proof cotton yarn and manufacturing process thereof 苍南县磊升纺织有限公司 2023-04-14 CN disclosed
CN-115917706-A Temporary fixing material and method for manufacturing electronic component 积水化学工业株式会社 2023-04-04 CN disclosed
US-4396696-A Electrophotographic plate having azo compound photosensitive layer MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1983-08-02 US disclosed
EP-0063387-A1 Electrophotographic plate MITSUBISHI KASEI CORPORATION (JP) 1982-10-27 EP disclosed
US-4327209-A Process for the production of dibenzazolyl compounds CIBA-GEIGY CORPORATION (US) 1982-04-27 US disclosed
EP-0031296-A1 Method for the preparation of benzazolyl compounds CIBA-GEIGY AG (CH) 1981-07-01 EP disclosed
US-3997553-A 2-Benzimidazolecarbamic acid esters by the cyanamide process E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-12-14 US disclosed
US-3987003-A THERMALLY STABLE DIOXO AND DITHIO-BENZISOQUINOLINE COMPOSITIONS AND PROCESS OF SYNTHESIZING SAME THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1976-10-19 US disclosed
US-3965092-A HEAT EXCHANGE, SURFACTANTS PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1976-06-22 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 (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-11912825-B2 Polymers derived from 2,2′-bisimidazoles PARG, PARN, NOP2 ALDH1A1 2052/4885GAA 2291/4885HTT 1245/4885
US-11883387-B2 PqsR inverse agonists QRFPR, P2RY11, QARS1 ALDH1A1 4593/4885GAA 3075/4885HTT 3291/4885

“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.