SCHEMBL5273

SCHEMBL5273

O=C(c1ccncc1)N1CCNCC1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.70
MKNK1 Q9BUB5 1/20 0.63
MKNK2 Q9HBH9 1/20 0.63
HPGD P15428 1/20 0.58
CHRNB2 P17787 2/20 0.57
CHRNB4 P30926 2/20 0.57
CHRNA3 P32297 2/20 0.57
CHRNA4 P43681 2/20 0.57
CHRNA7 P36544 1/20 0.57
CYP3A4 P08684 2/20 0.53
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
AKR1C3 P42330 1/20 0.53
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
HSD17B10 Q99714 1/20 0.51
GAA P10253 1/20 0.50
RIPK1 Q13546 1/20 0.50
ALDH1A1 P00352 1/20 0.50

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 SCHEMBL1597605 0.98 SIGMAR1 (0.68) SIGMAR1MKNK1MKNK2HPGDCHRNB2
SCHEMBL7425708 0.92 MKNK1 (0.72) SIGMAR1MKNK1MKNK2HPGDRIPK1
Trifluoroacetic Acid SCHEMBL3961759 0.89 SIGMAR1 (0.61) SIGMAR1MKNK1MKNK2HPGDCHRNB2
Pyridine SCHEMBL28123146 0.88 SIGMAR1 (0.81) SIGMAR1MKNK1MKNK2HPGDTSHR
SCHEMBL8358137 0.88 SIGMAR1 (0.81) SIGMAR1MKNK1MKNK2HPGDALDH1A1
SCHEMBL12893509 0.85 MKNK1 (0.53) SIGMAR1MKNK1MKNK2HPGDCHRNB2
Tert-Butyl Formate SCHEMBL28289050 0.84 HPGD (0.55) SIGMAR1MKNK1MKNK2HPGDCHRNB2
Hydrochloric Acid SCHEMBL1597604 0.84 TSHR (0.64) HPGDCYP3A4TP53TSHRSMN1; SMN2
SCHEMBL4229238 0.83 GABRD (0.71) CYP3A4TSHRCYP2C9CYP2C19HSD17B10
Trifluoroacetic Acid SCHEMBL6199874 0.83 L3MBTL1 (0.62) SIGMAR1MKNK1MKNK2HPGDCYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103992338-B A kind of copper complex based on two pyridine piperazine part and Anderson type polyacid and synthetic method thereof and application BOHAI UNIVERSITY (CN) 2016-04-13 CN claimed
US-20260116923-A1 CYCLIC PEPTIDE IL-1BETA TRAP FOR THE TREATMENT OF ATHEROSCLEROSIS AND INFLAMMATORY DISORDERS MERCK SHARP & DOHME LLC (US) 2026-04-30 US disclosed
EP-4574153-A2 KINASE INHIBITORS FOR THE TREATMENT OF CENTRAL AND PERIPHERAL NERVOUS SYSTEM DISORDERS University of Miami (US) 2025-06-25 EP disclosed
US-20250188092-A1 RIFAMYCIN ANALOGS THE PENN STATE RESEARCH FOUNDATION 2025-06-12 US disclosed
US-20250145586-A1 KINASE INHIBITORS FOR THE TREATMENT OF CENTRAL AND PERIPHERAL NERVOUS SYSTEM DISORDERS UNIVERSITY OF MIAMI 2025-05-08 US disclosed
EP-3704103-B1 KINASE INHIBITORS FOR THE TREATMENT OF CENTRAL AND PERIPHERAL NERVOUS SYSTEM DISORDERS UNIV MIAMI (US) 2025-01-01 EP disclosed
CN-111801322-B Kinase inhibitors for the treatment of central and peripheral nervous system disorders 迈阿密大学 2024-03-15 CN disclosed
US-11926613-B2 Kinase inhibitors for the treatment of central and peripheral nervous system disorders UNIVERSITY OF MIAMI (US) 2024-03-12 US disclosed
CN-117682988-A Wangzaozi B derivative, and preparation method and application thereof 宿州绿源中医药科技有限公司 2024-03-12 CN disclosed
US-11407719-B2 Anti-inflammatory agents RESVERLOGIX CORP. (CA) 2022-08-09 US disclosed
US-7468371-B2 Tricyclic pyrazole kinase inhibitors ABBOTT LABORATORIES INC. (US) 2008-12-23 US disclosed
EP-1970373-A1 ALICYCLIC HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2008-09-17 EP disclosed
EP-1440976-B1 Modified aminoacids, pharmaceuticals containing these compounds and method for their production BOEHRINGER INGELHEIM PHARMA (DE) 2008-07-23 EP disclosed
EP-1740579-A1 TRICYCLIC PYRAZOLE KINASE INHIBITORS Abbott Laboratories (US) 2007-01-10 EP disclosed
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors ABBVIE INC. 2006-01-19 US disclosed
WO-2005095387-A1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2005-10-13 WO disclosed
EP-0703908-A1 ANALGESIC DIBENZOXAZEPINES AND DIBENZOTHIAZEPINES G.D. SEARLE & CO. (US) 1996-04-03 EP disclosed
US-5461047-A Analgesics and treats prostaglandin-E2 mediated diseases in animals G. D. SEARLE & CO. (US) 1995-10-24 US disclosed
WO-1994029286-A1 ANALGESIC DIBENZOXAZEPINES AND DIBENZOTHIAZEPINES G.D. SEARLE & CO. (US) 1994-12-22 WO disclosed
US-5354747-A Analgesics G. D. SEARLE & CO. (US) 1994-10-11 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 (6 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-11407719-B2 Anti-inflammatory agents VCAM1, ICAM1, IL6 SIGMAR1 3026/4885MKNK1 1777/4885MKNK2 1955/4885
US-20260116923-A1 CYCLIC PEPTIDE IL-1BETA TRAP FOR THE TREATMENT OF ATHEROSCLEROSIS AND INFLAMMATORY DISORDERS IL1A, IL1B, IL1RN SIGMAR1 938/4885MKNK1 1928/4885MKNK2 2358/4885
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors PRKDC, PRKACA, PIK3C3 SIGMAR1 3134/4885MKNK1 74/4885MKNK2 47/4885
US-11926613-B2 Kinase inhibitors for the treatment of central and peripheral nervous system disorders PNCK, PYGB, PMP22 SIGMAR1 1713/4885MKNK1 114/4885MKNK2 126/4885
US-20250188092-A1 RIFAMYCIN ANALOGS CYP3A4, CYP4B1, CYP2C9 SIGMAR1 1001/4885MKNK1 2665/4885MKNK2 2463/4885
US-20250145586-A1 KINASE INHIBITORS FOR THE TREATMENT OF CENTRAL AND PERIPHERAL NERVOUS SYSTEM DISORDERS MAP3K20, MAP4K2, MAP4K1 SIGMAR1 2242/4885MKNK1 68/4885MKNK2 93/4885

“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.