SCHEMBL231983

SCHEMBL231983

N#Cc1ccc(N2CCNCC2)nc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
PLD1 Q13393 1/20 0.50
PANK3 Q9H999 7/20 0.49
GPR119 Q8TDV5 1/20 0.49
HRH4 Q9H3N8 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49
SMO Q99835 3/20 0.48
DRD2 P14416 1/20 0.46
DRD3 P35462 1/20 0.46
GPR39 O43194 1/20 0.45
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45

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
SCHEMBL30390836 1.00 KDM4E (0.51) KDM4EALDH1A1L3MBTL1PLD1PANK3
Hydrochloric Acid SCHEMBL30731344 0.98 KDM4E (0.50) KDM4EALDH1A1L3MBTL1PLD1PANK3
Hydrochloric Acid SCHEMBL21521443 0.98 KDM4E (0.50) KDM4EALDH1A1L3MBTL1PLD1PANK3
Hydrochloric Acid SCHEMBL23302464 0.98 KDM4E (0.50) KDM4EALDH1A1L3MBTL1PLD1PANK3
Hydrochloric Acid SCHEMBL17455098 0.98 KDM4E (0.50) KDM4EALDH1A1L3MBTL1PLD1PANK3
SCHEMBL2003952 0.94 KDR (0.50) KDM4EALDH1A1L3MBTL1PLD1PANK3
Hydrochloric Acid SCHEMBL31465050 0.92 KDR (0.49) KDM4EALDH1A1L3MBTL1PLD1PANK3
SCHEMBL7257034 0.90 KDM4E (0.49) KDM4EALDH1A1L3MBTL1PANK3GPR119
SCHEMBL12911541 0.87 GPR119 (0.55) PLD1GPR119HRH4HRH3
Hydrochloric Acid SCHEMBL943137 0.86 GPR119 (0.54) PLD1GPR119HRH4HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260109686-A1 PYRIDAZIN-3(2H)-ONE AND PYRIDIN-2(1H)-ONE PARP INHIBITOR COMPOUNDS AZKARRA THERAPEUTICS, INC. (US) 2026-04-23 US disclosed
US-20260070884-A1 Inhibitors of Dihydroceramide Desaturase for Treating Disease CENTAURUS THERAPEUTICS (US) 2026-03-12 US disclosed
US-20260062422-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO INC (US) 2026-03-05 US disclosed
US-12503458-B2 5-hydroxytryptamine receptor 7 activity modulators and their method of use TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2025-12-23 US disclosed
US-20250289800-A1 Selective Parp1 Inhibitor And Application Thereof KANGBAIDA (SICHUAN) BIOTECHNOLOGY CO., LTD. (CN) 2025-09-18 US disclosed
US-12384780-B2 PARP1 inhibitors and uses thereof XINTHERA, INC. (US) 2025-08-12 US disclosed
EP-4594314-A1 PYRIDAZIN-3(2H)-ONE AND PYRIDIN-2(1H)-ONE PARP INHIBITOR COMPOUNDS Azkarra Therapeutics, Inc. (US) 2025-08-06 EP disclosed
US-20250163030-A1 PYRIDIZIN-3(2H)-ONE DERIVATIVES GILEAD SCIENCES, INC. 2025-05-22 US disclosed
CN-120020129-A Substituted nitrogen-containing bicyclic compounds and uses thereof 广东东阳光药业股份有限公司 2025-05-20 CN disclosed
EP-3728234-B1 RADIOLABELED COMPOUNDS HOFFMANN LA ROCHE (CH) 2025-05-14 EP disclosed
WO-2003087071-A1 SULFONAMIDE DERIVATIVES CELLTECH R & D LIMITED (GB) 2003-10-23 WO disclosed
EP-1308439-A1 PROLINE DERIVATIVES AND USE THEREOF AS DRUGS WELFIDE CORPORATION (JP) 2003-05-07 EP disclosed
WO-2002074767-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO disclosed
WO-2002074750-A1 METALLOPROTEINASE INHIBITORS ASTRAZENECA AB (SE) 2002-09-26 WO disclosed
US-5442064-A Anticoagulants, antiagglomerants DR. KARL THOMAE GMBH (DE) 1995-08-15 US disclosed
CN-1090273-A Acetogenin GLAXO GROUP LTD (GB) 1994-08-03 CN disclosed
CN-1087904-A Carboxylic acid derivative, the pharmaceutical composition that contains these compounds with and preparation method thereof KRAL THOMAE GMBH (DE) 1994-06-15 CN disclosed
EP-0592949-A2 N-(aminocarbonyl)-piperidines/pepirazines as aggregation inhibiting agents Dr. Karl Thomae GmbH (DE) 1994-04-20 EP disclosed
CN-1073169-A Acetogenin GLAXO GROUP LTD (GB) 1993-06-16 CN disclosed
EP-0542363-A2 Piperidineacetic acid derivatives as inhibitors of fibrinogen-dependent blood platelet aggregation GLAXO GROUP LIMITED (GB) 1993-05-19 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 (7 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-12503458-B2 5-hydroxytryptamine receptor 7 activity modulators and their method of use HTR7, HTR5A, HTR6 KDM4E 2700/4885ALDH1A1 2423/4885L3MBTL1 4177/4885
US-12384780-B2 PARP1 inhibitors and uses thereof PARP1, PARP11, PARP12 KDM4E 1632/4885ALDH1A1 1913/4885L3MBTL1 1069/4885
US-20260070884-A1 Inhibitors of Dihydroceramide Desaturase for Treating Disease CERS2, DEGS1, CERT1 KDM4E 2514/4885ALDH1A1 1500/4885L3MBTL1 1806/4885
US-20250289800-A1 Selective Parp1 Inhibitor And Application Thereof PARP1, PARP11, PARP12 KDM4E 1388/4885ALDH1A1 1859/4885L3MBTL1 2199/4885
US-20260109686-A1 PYRIDAZIN-3(2H)-ONE AND PYRIDIN-2(1H)-ONE PARP INHIBITOR COMPOUNDS PARP2, PARP1, PARP11 KDM4E 3606/4885ALDH1A1 1213/4885L3MBTL1 523/4885
US-20250163030-A1 PYRIDIZIN-3(2H)-ONE DERIVATIVES PIR, CYP3A43, CYP1A2 KDM4E 3408/4885ALDH1A1 401/4885L3MBTL1 4647/4885
US-20260062422-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE BRD4, AR, BRD3 KDM4E 553/4885ALDH1A1 2552/4885L3MBTL1 1282/4885

“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.