SCHEMBL2568795

SCHEMBL2568795

N#Cc1ccc(-c2ccncc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 2/20 0.61
▸ MMP3 P08254 1/20 0.56
▸ KIF11 P52732 2/20 0.56
▸ LMNA P02545 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ GSK3A P49840 2/20 0.51
▸ GSK3B P49841 2/20 0.51
▸ MAPK14 Q16539 3/20 0.50
▸ MAPK13 O15264 2/20 0.50
▸ MAPK12 P53778 2/20 0.50
▸ MAPK11 Q15759 2/20 0.50
▸ RAF1 P04049 1/20 0.50
▸ GCGR P47871 2/20 0.49
▸ ALOX5 P09917 1/20 0.49
▸ CYP11B1 P15538 1/20 0.49
▸ CCNC P24863 1/20 0.48
▸ CDK8 P49336 1/20 0.48
▸ PKN1 Q16512 1/20 0.47
▸ PKN2 Q16513 1/20 0.47
▸ CA12 O43570 1/20 0.47

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
SCHEMBL13063634 1.00 CYP11B2 (0.61) CYP11B2MMP3KIF11LMNAMAPT
SCHEMBL25543310 0.88 CYP11B2 (0.50) CYP11B2MMP3KIF11LMNAMAPT
SCHEMBL25543818 0.88 CYP11B2 (0.50) CYP11B2MMP3KIF11LMNAMAPT
SCHEMBL15159900 0.88 LRRK2 (0.60) CYP11B2MMP3KIF11GSK3AGSK3B
SCHEMBL30500119 0.85 CYP11B2 (0.52) CYP11B2MMP3KIF11LMNAMAPT
Isonicotinonitrile SCHEMBL151611 0.84 — —
Isonicotinonitrile SCHEMBL2015834 0.84 HDAC8 (0.52) CYP11B2KIF11LMNAMAPTCYP11B1
Isonicotinonitrile SCHEMBL12264099 0.84 — —
Water SCHEMBL11055485 0.84 MMP3 (0.74) CYP11B2MMP3KIF11CA12CA1
SCHEMBL396846 0.84 MMP3 (0.74) CYP11B2MMP3KIF11CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4727944-A1 [1,2,4]-TRIAZOLO[4,3-B]PYRIDAZINE DERIVATIVES USEFUL AS A MEDICAMENT Perha Pharmaceuticals (FR) 2026-04-22 — — EP disclosed
CN-120028308-A Small molecule Raman probe, bar code probe, encoding method and application thereof 北京大学 2025-05-23 — — CN disclosed
WO-2024256496-A1 [1,2,4]-TRIAZOLO[4,3-B]PYRIDAZINE DERIVATIVES USEFUL AS A MEDICAMENT PERHA PHARMACEUTICALS (FR) 2024-12-19 — — WO disclosed
EP-4477653-A1 [1,2,4]-TRIAZOLO[4,3-B]PYRIDAZINE DERIVATIVES USEFUL AS A MEDICAMENT Perha Pharmaceuticals (FR) 2024-12-18 — — EP disclosed
CN-111909133-B Substituted 1-amino-1H-imidazole-5-carboxamides as inhibitors of brunauer tyrosine kinase 河南知微生物医药有限公司 2023-07-14 — — CN disclosed
US-20220177451-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS DUB INHIBITORS MISSION THERAPEUTICS LIMITED (GB) 2022-06-09 — — US disclosed
US-11352339-B2 1-cyano-pyrrolidine derivatives as DUB inhibitors MISSION THERAPEUTICS LIMITED (GB) 2022-06-07 — — US disclosed
EP-3433246-B1 1-CYANO-PYRROLIDINE DERIVATIVES AS DBU INHIBITORS MISSION THERAPEUTICS LTD (GB) 2022-05-04 — — EP disclosed
CN-112142989-A Preparation method of mesoporous MOFs material 北京大学深圳研究生院 2020-12-29 — — CN disclosed
US-20200331888-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS DUB INHIBITORS MISSION THERAPEUTICS LIMITED (GB) 2020-10-22 — — US disclosed
WO-1998014450-A1 PYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF NOVARTIS AG (CH) 1998-04-09 — — WO disclosed
EP-0612313-A1 PIPERIDINE ACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1994-08-31 — — EP disclosed
EP-0609282-A1 CYCLOHEXANEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1994-08-10 — — EP disclosed
CN-1090273-A Acetogenin GLAXO GROUP LTD (GB) 1994-08-03 — — CN disclosed
CN-1073433-A Cyclohexaneacetic acid derivatives GLAXO GROUP LTD (GB) 1993-06-23 — — CN disclosed
CN-1073169-A Acetogenin GLAXO GROUP LTD (GB) 1993-06-16 — — CN disclosed
WO-1993010091-A2 PIPERIDINE ACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1993-05-27 — — WO disclosed
EP-0542363-A2 Piperidineacetic acid derivatives as inhibitors of fibrinogen-dependent blood platelet aggregation GLAXO GROUP LIMITED (GB) 1993-05-19 — — EP disclosed
WO-1993008181-A1 CYCLOHEXANEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1993-04-29 — — WO disclosed
EP-0537980-A1 Cyclohexaneacetic acid derivatives as inhibitors of fibrinogen-dependent blood platelet aggregation GLAXO GROUP LIMITED (GB) 1993-04-21 — — EP 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 (3 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-11352339-B2 1-cyano-pyrrolidine derivatives as DUB inhibitors USP30, USP28, USP1 CYP11B2 3303/4885MMP3 2682/4885KIF11 3615/4885
US-20220177451-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS DUB INHIBITORS USP30, USP28, USP1 CYP11B2 3303/4885MMP3 2682/4885KIF11 3615/4885
US-20200331888-A1 1-CYANO-PYRROLIDINE DERIVATIVES AS DUB INHIBITORS USP30, USP28, USP1 CYP11B2 3303/4885MMP3 2682/4885KIF11 3615/4885

“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.

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