SCHEMBL427782

SCHEMBL427782

c1c[nH]c2c(c1)ccc1nncc12

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.36
CCNA2 P20248 10/20 0.34
CDK2 P24941 10/20 0.34
CCNA1 P78396 10/20 0.34
TGFBR1 P36897 1/20 0.32

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
Urea SCHEMBL1549376 0.91 CCNA2 (0.43) CCNA2CDK2CCNA1
SCHEMBL28420618 0.81 AHR (0.31) AHR
SCHEMBL8565229 0.80 AHR (0.37) AHR
SCHEMBL167198 0.75 CCNA2 (0.31) CCNA2CDK2CCNA1
SCHEMBL146383 0.73 CYP3A4 (0.44) AHR
SCHEMBL9837616 0.73 TGFBR1 (0.36) CCNA2CDK2CCNA1TGFBR1
SCHEMBL2150779 0.73 TNF (0.35) AHR
SCHEMBL1395066 0.73 TGFBR1 (0.36) CCNA2CDK2CCNA1TGFBR1
SCHEMBL9525697 0.71 MAPK10 (0.34) CCNA2CDK2CCNA1
SCHEMBL1133642 0.71 CCNA2 (0.34) CCNA2CDK2CCNA1

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 1411 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114394967-B Method for synthesizing pyrazoloquinoline derivative from 2-pyrazolyl aniline and 1, 3-dicarbonyl compound 宁夏农林科学院农业资源与环境研究所(宁夏土壤与植物营养重点实验室) 2023-12-15 CN claimed
CN-114213412-B Method for synthesizing pyrazoloquinoline compound from 2-pyrazoloaniline derivative and ether under acid catalysis 宁夏农林科学院农业资源与环境研究所(宁夏土壤与植物营养重点实验室) 2022-12-30 CN claimed
CN-115252618-A Application of pyrazoloquinoline derivative and pharmaceutical composition thereof 大连医科大学附属第二医院 2022-11-01 CN claimed
CN-113896725-B Pyrazoloquinoline compound and preparation method and application thereof 沈阳药科大学 2022-10-25 CN claimed
CN-115073544-A PARP inhibitor pyrazoloquinine derivative and synthesis method thereof 上海应用技术大学 2022-09-20 CN claimed
CN-114394967-A Method for synthesizing pyrazoloquinoline derivative from 2-pyrazoloaniline and 1, 3-dicarbonyl compound 宁夏农林科学院农业资源与环境研究所(宁夏土壤与植物营养重点实验室) 2022-04-26 CN claimed
CN-114213412-A Method for synthesizing pyrazoloquinoline compound from 2-pyrazoloaniline derivative and ether under acid catalysis 宁夏农林科学院农业资源与环境研究所(宁夏土壤与植物营养重点实验室) 2022-03-22 CN claimed
CN-113896725-A Pyrazoloquinoline compound and preparation method and application thereof 沈阳药科大学 2022-01-07 CN claimed
US-11005082-B2 Organic EL light-emitting element and manufacturing method thereof SAKAI DISPLAY PRODUCTS CORPORATION (JP) 2021-05-11 US claimed
US-10937985-B2 Organic EL light-emitting element and manufacturing method thereof SAKAI DISPLAY PRODUCTS CORPORATION (JP) 2021-03-02 US claimed
EP-1413286-A1 Dyeing composition comprising at least one heterocyclic oxidation base and at least one substituted 2,3-diaminopyridine as a coupling agent L'OREAL (FR) 2004-04-28 EP claimed
US-20030187014-A1 Condensed pyrazole derivatives, process for producing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-10-02 US claimed
EP-1270572-A1 CONDENSED PYRAZOLE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2003-01-02 EP claimed
EP-1002535-A1 New use of glutamate antagonists for the treatment of cancer Ikonomidou, Hrissanthi (DE) 2000-05-24 EP claimed
EP-0992240-A1 THERAPEUTIC AGENT FOR ERECTION FAILURE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-04-12 EP claimed
WO-1998049219-A1 PYRAZOL-BASED ELECTROLUMINESCENT POLYMERS AND THEIR USE IN ELECTROLUMINESCENT DEVICES THE UNIVERSITY COURT OF NAPIER UNIVERSITY (GB) 1998-11-05 WO claimed
EP-0476544-B1 Pyrazoloquinoline derivatives KYOWA HAKKO KOGYO KK (JP) 1995-05-10 EP claimed
EP-0476544-A1 Pyrazoloquinoline derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1992-03-25 EP claimed
US-4980379-A ENHANCING EFFICIENCY BY REDUCING ADENOSINE LEVELS THE UNIVERSITY OF VIRGINIA (US) 1990-12-25 US claimed
US-4904472-A Use of adenosine antagonists in the treatment of bradyarrhythmias and mechanical dysfunction associated with cardiopulmonary resuscitation THE UNIVERSITY OF VIRGINIA ALUMNI PATENT FOUNDATION (US) 1990-02-27 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20030187014-A1 Condensed pyrazole derivatives, process for producing the same and use thereof PTGS1, PTGIS, IL5 AHR 218/4885CCNA2 2520/4885CDK2 193/4885

“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.