SCHEMBL56495

SCHEMBL56495

Nc1ccc(OCCN2CCCC2)cc1

nearest known ligand 0.90

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 11/20 0.90
PTGS2 P35354 3/20 0.90
PTGS1 P23219 1/20 0.90
PSMB1 P20618 4/20 0.67
PSMB5 P28074 4/20 0.67
PSMB2 P49721 3/20 0.67
HRH3 Q9Y5N1 4/20 0.65
KDM4E B2RXH2 1/20 0.63
KCNH2 Q12809 1/20 0.62

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
Hydrochloric Acid SCHEMBL15254264 0.98 LTA4H (0.87) LTA4HPTGS2PTGS1PSMB1PSMB5
SCHEMBL23724061 0.98 LTA4H (0.87) LTA4HPTGS2PTGS1PSMB1PSMB5
SCHEMBL3937460 0.98 LTA4H (0.87) LTA4HPTGS2PTGS1PSMB1PSMB5
Hydrochloric Acid SCHEMBL3997911 0.96 LTA4H (0.84) LTA4HPTGS2PTGS1PSMB1PSMB5
SCHEMBL4457910 0.91 LTA4H (0.76) LTA4HPTGS2PTGS1HRH3KCNH2
SCHEMBL3398830 0.91 LTA4H (0.75) LTA4HPTGS2PTGS1PSMB1PSMB5
SCHEMBL2968936 0.89 HRH3 (0.75) LTA4HPTGS2PTGS1HRH3KCNH2
SCHEMBL16359559 0.89 LTA4H (0.73) LTA4HPTGS2PTGS1HRH3KCNH2
SCHEMBL4465869 0.89 HRH3 (0.75) LTA4HPTGS2PTGS1HRH3KCNH2
Hydrochloric Acid SCHEMBL736843 0.88 HRH3 (0.73) LTA4HPTGS2PTGS1HRH3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2282995-B1 DERIVATIVES OF QUINOLINES AND QUINOXALINES AS PROTEIN TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2015-08-26 EP claimed
US-8536175-B2 Quinoxaline carboxamide derivatives as protein tyrosine kinase inhibitors NOVARTIS AG (CH) 2013-09-17 US claimed
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES TARGEGEN, INC. (US) 2011-09-01 US claimed
EP-4673149-A1 NEW COMPOUNDS AND TREATMENT OF RENAL CELL CARCINOMA Trustlife Global Inc. (US) 2026-01-07 EP disclosed
US-12391676-B2 BRD4-JAK2 inhibitors H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2025-08-19 US disclosed
CN-120081789-A Pyrazole derivative with antitumor activity and preparation method and application thereof 天津匠新致成科技有限公司 2025-06-03 CN disclosed
CN-118891261-A Covalent EGFR inhibitors and methods of use thereof 丹娜-法伯癌症研究院 2024-11-01 CN disclosed
US-20240352021-A1 COVALENT EGFR INHIBITORS AND METHODS OF USE THEREOF THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2024-10-24 US disclosed
WO-2024179699-A1 NEW COMPOUNDS AND TREATMENT OF RENAL CELL CARCINOMA BASH BIOTECH INC. (US) 2024-09-06 WO disclosed
US-20240293406-A1 COMPOSITIONS AND METHODS FOR TREATING MYELOFIBROSIS IMPACT BIOMEDICINES INC (US) 2024-09-05 US disclosed
EP-4419529-A1 COVALENT EGFR INHIBITORS AND METHODS OF USE THEREOF Dana-Farber Cancer Institute, Inc. (US) 2024-08-28 EP disclosed
EP-1363904-A1 PYRAZOLES AS TGF INHIBITORS GLAXO GROUP LIMITED (GB) 2003-11-26 EP disclosed
US-20030199478-A1 3-(Arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ALLERGAN, INC. 2003-10-23 US disclosed
WO-2003033476-A1 PYRIMIDINONES AS MELANIN CONCENTRATING HORMONE RECEPTOR 1 SMITHKLINE BEECHAM PLC (GB) 2003-04-24 WO disclosed
WO-2003027102-A1 3-(ARYLAMINO)METHYLENE-1, 3-DIHYDRO-2H-INDOL-2-ONES AS KINASE INHIBITORS ALLERGAN, INC. (US) 2003-04-03 WO disclosed
EP-0997460-B1 Benzothiophene compounds as antithrombotic agents and intermediates LILLY CO ELI (US) 2002-12-11 EP disclosed
WO-2002062787-A1 PYRAZOLES AS TGF INHIBITORS GLAXO GROUP LIMITED (GB) 2002-08-15 WO disclosed
US-6133262-A 3-AMINOBENZO(B)THIOPHENE DERIVATIVES ELI LILLY AND COMPANY (US) 2000-10-17 US disclosed
EP-0997460-A1 Benzothiophene compounds as antithrombotic agents and intermediates ELI LILLY AND COMPANY (US) 2000-05-03 EP disclosed
US-3957999-A ADMINISTERING THE BOOTS COMPANY (EN) 1976-05-18 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 (5 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-20030199478-A1 3-(Arylamino)methylene-1, 3-dihydro-2H-indol-2-ones as kinase inhibitors ERBB2, MKI67, CDK2 LTA4H 4513/4885PTGS2 1351/4885PTGS1 1345/4885
US-20240352021-A1 COVALENT EGFR INHIBITORS AND METHODS OF USE THEREOF EGFR, ERBB2, ERBB3 LTA4H 3430/4885PTGS2 1771/4885PTGS1 1388/4885
US-20110212077-A1 BI-ARYL META-PYRIMIDINE INHIBITORS OF KINASES JAK2, TYK2, JAK3 LTA4H 3846/4885PTGS2 2287/4885PTGS1 2858/4885
US-12391676-B2 BRD4-JAK2 inhibitors BRD4, BICRA, JAK2 LTA4H 2445/4885PTGS2 1493/4885PTGS1 1375/4885
US-20240293406-A1 COMPOSITIONS AND METHODS FOR TREATING MYELOFIBROSIS JAK2, NPM1, MCL1 LTA4H 3892/4885PTGS2 1515/4885PTGS1 1740/4885

“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.