SCHEMBL7019371

SCHEMBL7019371

Cc1nc(C)c2nc[nH]c2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 2/20 0.36
PARP1 P09874 2/20 0.32
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CSNK2A2 P19784 2/20 0.30
CSNK2A1 P68400 2/20 0.30
TP53 P04637 1/20 0.30
PTGS1 P23219 1/20 0.30
HBB P68871 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
MEN1 O00255 1/20 0.30
RAB9A P51151 1/20 0.30
CSNK2B P67870 1/20 0.30
KMT2A Q03164 1/20 0.30
DYRK1A Q13627 1/20 0.30

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
Ammonia Solution, Strong SCHEMBL16871771 0.98 PDPK1 (0.35) PDPK1PARP1KDM4EALDH1A1HPGD
SCHEMBL1193368 0.79 PDPK1 (0.34) PDPK1PARP1
SCHEMBL2938699 0.79 PDPK1 (0.37) PDPK1KDM4EALDH1A1HPGDHSD17B10
SCHEMBL4451632 0.79 XDH (0.40) PDPK1PARP1KDM4ECSNK2A1DYRK1A
SCHEMBL9925954 0.79 PDPK1 (0.34) PDPK1PARP1DYRK1A
SCHEMBL9465638 0.79 PDPK1 (0.34) PDPK1PARP1CSNK2A2CSNK2A1MEN1
SCHEMBL753115 0.79 PDK2 (0.38) PDPK1PARP1KDM4EALDH1A1HPGD
SCHEMBL21684954 0.79 CSNK2A1 (0.36) PDPK1PARP1CSNK2A2CSNK2A1
SCHEMBL1371017 0.79 PDPK1 (0.31) PDPK1PARP1
SCHEMBL11334542 0.79 LMNA (0.33) PDPK1PARP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119433594-A Lignin derived carbon-alloy-metal oxide heterojunction catalyst and preparation method thereof 广西大学 2025-02-14 CN claimed
CN-117199398-A Molybdenum-doped nickel-cobalt-copper lattice stretching alloy catalyst and preparation method thereof 广西大学 2023-12-08 CN claimed
EP-4680228-A2 OPHTHALMIC CREAM FORMULATIONS AND THEIR USES Glaukos Corporation (US) 2026-01-21 EP disclosed
CN-119433594-A Lignin derived carbon-alloy-metal oxide heterojunction catalyst and preparation method thereof 广西大学 2025-02-14 CN disclosed
US-20240316028-A1 OPHTHALMIC CREAM FORMULATIONS AND THEIR USES GLAUKOS CORP (US) 2024-09-26 US disclosed
WO-2024192323-A2 OPHTHALMIC CREAM FORMULATIONS AND THEIR USES GLAUKOS CORPORATION (US) 2024-09-19 WO disclosed
CN-117199398-A Molybdenum-doped nickel-cobalt-copper lattice stretching alloy catalyst and preparation method thereof 广西大学 2023-12-08 CN disclosed
US-20230138901-A1 COMPOUND HAVING KHK INHIBITORY EFFECT HANGZHOU ZHONGMEIHUADONG PHARMACEUTICAL CO., LTD. (CN) 2023-05-04 US disclosed
EP-3889152-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2021-10-06 EP disclosed
WO-2020108613-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF 江苏豪森药业集团有限公司 2020-06-04 WO disclosed
US-9834568-B2 Kinase inhibitors and their uses RIGEL PHARMACEUTICALS, INC. (US) 2017-12-05 US disclosed
US-20080108612-A1 6-(phenylmethyl)amino-1H-purine; chaperone protein inhibitor; anticarcinogenic agent AVENTIS PHARMA S.A. (FR) 2008-05-08 US disclosed
US-20080090849-A1 NOVEL PURINE DERIVATIVES, PREPARATION METHOD AND USE AS MEDICINES AVENTIS PHARMA S.A. (FR) 2008-04-17 US disclosed
US-7307167-B2 Production method of 2,6-dihalopurine SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-12-11 US disclosed
CN-1553909-A Benzimidazole and pyridylimidazole derivatives as ligands for GABA receptors 2004-12-08 CN disclosed
EP-1368342-A2 BENZIMIDAZOLE AND PYRIDYLIMIDAZOLE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS NEUROGEN CORPORATION (US) 2003-12-10 EP disclosed
EP-0755255-A4 TREATMENT OF TOXOPLASMOSIS RES CORP TECHNOLOGIES INC (US) 2002-07-24 EP disclosed
WO-2002050062-A2 BENZIMIDAZOLE AND PYRIDYLIMIDAZOLE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS NEUROGEN CORPORATION (US) 2002-06-27 WO disclosed
EP-0755255-A1 TREATMENT OF TOXOPLASMOSIS UNIVERSITY OF ALABAMA, BIRMINGHAM RESEARCH FOUNDATION (US) 1997-01-29 EP disclosed
WO-1996018398-A1 TREATMENT OF TOXOPLASMOSIS THE UNIVERSITY OF ALABAMA AT BIRMINGHAM RESEARCH FOUNDATION (US) 1996-06-20 WO 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-20080108612-A1 6-(phenylmethyl)amino-1H-purine; chaperone protein inhibitor; anticarcinogenic agent HSP90B1, HSPBP1, HSP90AB2P PDPK1 2216/4885PARP1 653/4885KDM4E 3806/4885
US-20080090849-A1 NOVEL PURINE DERIVATIVES, PREPARATION METHOD AND USE AS MEDICINES CDK1, CDK6, PNP PDPK1 87/4885PARP1 351/4885KDM4E 1381/4885
US-20230138901-A1 COMPOUND HAVING KHK INHIBITORY EFFECT KHK, KHDRBS1, KHSRP PDPK1 155/4885PARP1 4253/4885KDM4E 641/4885
US-20240316028-A1 OPHTHALMIC CREAM FORMULATIONS AND THEIR USES PDE12, TBXA2R, PDE6G PDPK1 2635/4885PARP1 2601/4885KDM4E 3545/4885

“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.