SCHEMBL613358

SCHEMBL613358

Nc1ccc(Sc2ccc(N)c(N)c2)cc1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.48
TDP1 Q9NUW8 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
TSHR P16473 2/20 0.48
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.43
ALOX15 P16050 3/20 0.43
ALDH1A1 P00352 3/20 0.43
TP53 P04637 1/20 0.43
THRB P10828 1/20 0.43
NR4A1 P22736 1/20 0.42
PTK2 Q05397 1/20 0.39
KCNH2 Q12809 2/20 0.38
MAPT P10636 4/20 0.37
ANXA2 P07355 1/20 0.36
S100A10 P60903 1/20 0.36
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
NR1H2 P55055 1/20 0.35

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
SCHEMBL7869707 0.90 CYP3A4 (0.67) CYP3A4TDP1MEN1KMT2ATSHR
SCHEMBL30398364 0.88 MAOA (0.47) CYP3A4TDP1MEN1KMT2ATSHR
SCHEMBL6366825 0.88 MAOA (0.47) CYP3A4TDP1MEN1KMT2ATSHR
SCHEMBL928688 0.86 NR1H2 (0.61) CYP3A4TDP1MEN1KMT2ATSHR
SCHEMBL11630774 0.86 TDP1 (0.56) CYP3A4TDP1MEN1KMT2ATSHR
SCHEMBL29053002 0.86 MEN1 (0.49) CYP3A4TDP1MEN1KMT2ATSHR
SCHEMBL11723687 0.84 DDAH1 (0.58) CYP3A4TDP1MEN1KMT2ATSHR
SCHEMBL7858671 0.84 ANXA2 (0.44) CYP3A4TDP1MEN1KMT2ATSHR
SCHEMBL11728440 0.82 KCNH2 (0.50) CYP3A4TDP1MEN1KMT2ATSHR
SCHEMBL11370212 0.82 TDP1 (0.48) CYP3A4TDP1MEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11078581-B2 Catalyst composite and method for manufacturing the same UNIST (ULSAN NATIONAL INSTITUTE OF SCIENCE AND TECHNOLOGY) (KR) 2021-08-03 US claimed
US-20200240026-A1 CATALYST COMPOSITE AND METHOD FOR MANUFACTURING THE SAME UNIST (ULSAN NATIONAL INSTITUTE OF SCIENCE AND TECHNOLGY) (KR) 2020-07-30 US claimed
WO-2018155767-A1 CATALYST COMPLEX AND PRODUCTION METHOD THEREFOR 울산과학기술원 2018-08-30 WO claimed
US-20180066110-A1 NOVEL POLYAMIDEIMIDE HAVING LOW THERMAL EXPANSION COEFFICIENT KOREA ADVANCED INST SCI & TECH (KR) 2018-03-08 US claimed
CN-105175726-B High index of refraction polyaryl thioether sulfone film and preparation method thereof 四川大学 2017-05-31 CN claimed
US-20160194449-A1 NOVEL POLYAMIDEIMIDE HAVING LOW THERMAL EXPANSION COEFFICIENT KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-07-07 US claimed
CN-105175726-A High-refractive-index polyarylenesulfidesulfone film and preparation method thereof UNIV SICHUAN 2015-12-23 CN claimed
EP-2940015-A1 NOVEL POLYAMIDEIMIDE HAVING LOW THERMAL EXPANSION COEFFICIENT Korea Advanced Institute of Science and Technology (KR) 2015-11-04 EP claimed
US-20150045481-A1 Asymmetric Diamine Compounds Containing Two Functional Groups and Polymers Therefrom KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-02-12 US claimed
US-4731442-A High temperature solvent resistant amorphous thermoplastic phenylethynyl quinoxaline resin composition THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (US) 1988-03-15 US claimed
US-4253979-A HAVING GOOD HIGH TEMPERATURE PROPERTIES EXXON RESEARCH & ENGINEERING CO. (US) 1981-03-03 US claimed
US-4045414-A New di-substituted meta-terphenyl compounds and resulting polymers INSTITUT FRANCAIS DU PETROLE (FR) 1977-08-30 US claimed
WO-2023048273-A1 MODIFIED EPOXY RESIN AND ELECTRODEPOSITION COATING MATERIAL 関西ペイント株式会社 2023-03-30 WO disclosed
US-11078581-B2 Catalyst composite and method for manufacturing the same UNIST (ULSAN NATIONAL INSTITUTE OF SCIENCE AND TECHNOLOGY) (KR) 2021-08-03 US disclosed
EP-3807340-A1 POLYBENZIMIDAZOLE OLIGOMERS WITH REACTIVE END GROUPS PBI Performance Products, Inc. (US) 2021-04-21 EP disclosed
US-10934395-B2 Polybenzimidazole oligomers with reactive end groups PBI PERFORMANCE PRODUCTS, INC. (US) 2021-03-02 US disclosed
US-3985679-A POLY(BISBENIMIDAZOBENZOPHENANTHROLINE) CELANESE CORPORATION (US) 1976-10-12 US disclosed
US-3969325-A Production of particulate BBB type polymer having an unusually high surface area CELANESE CORPORATION (US) 1976-07-13 US disclosed
US-3969430-A Processability of intractable polymers CELANESE CORPORATION (US) 1976-07-13 US disclosed
US-3966729-A Addition curable phenyl-quinoxaline compositions and their synthesis THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE AIR FORCE (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 (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-20150045481-A1 Asymmetric Diamine Compounds Containing Two Functional Groups and Polymers Therefrom AOC1, INMT, PRMT6 CYP3A4 4558/4885TDP1 1884/4885MEN1 3873/4885
US-20180066110-A1 NOVEL POLYAMIDEIMIDE HAVING LOW THERMAL EXPANSION COEFFICIENT RICTOR, SGTA, SLC43A1 CYP3A4 4322/4885TDP1 3682/4885MEN1 3853/4885
US-10934395-B2 Polybenzimidazole oligomers with reactive end groups PBRM1, PHB2, PHB1 CYP3A4 2238/4885TDP1 1550/4885MEN1 1717/4885
US-20160194449-A1 NOVEL POLYAMIDEIMIDE HAVING LOW THERMAL EXPANSION COEFFICIENT SGTA, RICTOR, SLC43A1 CYP3A4 4328/4885TDP1 3798/4885MEN1 3959/4885

“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.