SCHEMBL126487

SCHEMBL126487

O=C(O)c1c[c]ccn1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8316521 0.80
SCHEMBL1904555 0.80
SCHEMBL1620220 0.77 HPGD (0.40)
SCHEMBL7085583 0.75 ADORA3 (0.31)
SCHEMBL2447373 0.75 ALDH1A1 (0.33)
SCHEMBL14167599 0.72 XIAP (0.31)
SCHEMBL2878233 0.71 SMN1; SMN2 (0.33)
SCHEMBL129258 0.71 ALDH1A1 (0.37)
SCHEMBL2442845 0.71 L3MBTL1 (0.46)
SCHEMBL6280315 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110746479-B Compound and preparation method and application thereof 山东师范大学 2021-01-08 CN claimed
CN-110746479-A Compound and preparation method and application thereof 山东师范大学 2020-02-04 CN claimed
US-20040101523-A1 Renal-selective prodrugs for control of renal smpathetic nerve activity in the treatment of hypertension G.D. SEARLE & CO. 2004-05-27 US claimed
US-20030220521-A1 Renal-selective prodrugs for control of renal sympathetic nerve activity in the treatment of hypertension G.D. SEARLE & CO. 2003-11-27 US claimed
EP-0484437-A4 RENAL-SELECTIVE PRODRUGS FOR THE TREATMENT OF HYPERTENSION SEARLE & CO (US) 1994-06-01 EP claimed
EP-0484437-A1 RENAL-SELECTIVE PRODRUGS FOR THE TREATMENT OF HYPERTENSION G.D. Searle & Co. (US) 1992-05-13 EP claimed
WO-1992001667-A1 RENAL-SELECTIVE PRODRUGS FOR CONTROL OF RENAL SYMPATHETIC NERVE ACTIVITY IN THE TREATMENT OF HYPERTENSION G.D. SEARLE & CO. (US) 1992-02-06 WO claimed
WO-1991001724-A1 RENAL-SELECTIVE PRODRUGS FOR THE TREATMENT OF HYPERTENSION G.D. SEARLE & CO. (US) 1991-02-21 WO claimed
US-4160835-A Antihypertensive compositions containing an arylsubstituted alanine and a phenyl hydrazinopropionic acid MERCK & CO., INC. (US) 1979-07-10 US claimed
US-20230310358-A1 Compositions And Methods For Treating Autism YAMO PHARMACEUTICALS LLC (US) 2023-10-05 US disclosed
CN-114901272-A Sustained release preparation 霍夫曼技术有限责任公司 2022-08-12 CN disclosed
US-20220211650-A1 SUSTAINED RELEASE FORMULATIONS HOFFMAN TECHNOLOGIES LLC 2022-07-07 US disclosed
EP-3955910-A1 SUSTAINED RELEASE FORMULATIONS Hoffman Technologies LLC. (US) 2022-02-23 EP disclosed
US-20210338619-A1 COMPOSITIONS AND METHODS FOR TREATING AUTISM YAMO PHARMACEUTICALS LLC 2021-11-04 US disclosed
US-4308269-A ANTITUMOUR AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-12-29 US disclosed
US-4278793-A ANTIBIOTICS, BACTERICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1981-07-14 US disclosed
EP-0021173-A1 Maytansinoids, their production and use Takeda Chemical Industries, Ltd. (JP) 1981-01-07 EP disclosed
US-4170654-A Antihypertensive compositions containing N-heterocyclicalanines and α- MERCK & CO., INC. (US) 1979-10-09 US disclosed
US-4160835-A Antihypertensive compositions containing an arylsubstituted alanine and a phenyl hydrazinopropionic acid MERCK & CO., INC. (US) 1979-07-10 US disclosed
US-4156734-A Antihypertensive compositions containing an aryl-substituted alanine azo and an arylhydrazino-propionic acid MERCK & CO., INC. (US) 1979-05-29 US disclosed