SCHEMBL6575015

SCHEMBL6575015

CO[C@H](C)C(=O)Cl

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
SCHEMBL660278 1.00
SCHEMBL8686530 1.00
SCHEMBL19821509 0.80
SCHEMBL18651225 0.80
SCHEMBL5202436 0.75
SCHEMBL6843879 0.73 SMN1; SMN2 (0.33)
SCHEMBL21003633 0.73
SCHEMBL20999997 0.73
SCHEMBL11801385 0.71
SCHEMBL2579180 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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210246130-A1 DUAL INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE DELTA &amp; GAMMA ASTRAZENECA AB (SE) 2021-08-12 US disclosed
US-10961236-B2 (S)-2-(1-cyclopropylethyl)-5-(4-methyl-2-((6-(2-oxopyrrolidin-1-yl)pyridin-2-yl)amino) thiazol-5-yl)-7-(methylsulfonyl)isoindolin-1-one as a phosphatidylinositol 3-kinase inhibitor ASTRAZENECA AB (SE) 2021-03-30 US disclosed
US-20200308164-A1 5-[2-(PYRIDIN-2-YLAMINO)-1,3-THIAZOL-5-YL]-2,3-DIHYDRO-1 H-ISOINDOL-1 -ONE DERIVATIVES AND THEIR USE AS DUAL INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE DELTA &amp; GAMMA ASTRAZENECA AB (SE) 2020-10-01 US disclosed
EP-3515910-B1 5-[2-(PYRIDIN-2-YLAMINO)-1,3-THIAZOL-5-YL]-2,3-DIHYDRO-1H-ISOINDOL-1-ONE DERIVATIVES AND THEIR USE AS DUAL INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE DELTA &amp; GAMMA ASTRAZENECA AB (SE) 2020-07-15 EP disclosed
CN-109715623-A 5- [2- (pyridin-2-ylamino) -1, 3-thiazol-5-yl ] -2, 3-dihydro-1H-isoindol-1-one derivatives and their use as dual inhibitors of phosphatidylinositol 3-kinase delta and gamma 阿斯利康(瑞典)有限公司 2019-05-03 CN disclosed
EP-1154983-B1 NOVEL SUBSTITUTED 3-PHENOXY AND 3-PHENYLALKYLOXY-2-PHENYL-PROPYLAMINES BOEHRINGER INGELHEIM PHARMA (DE) 2004-04-28 EP disclosed
US-6441237-B1 DRUGS; ANTIARRHTHYMIA AGENTS, ANTIISCHEMIC AGENTS BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-08-27 US disclosed
EP-1154983-A1 NOVEL SUBSTITUTED 3-PHENOXY AND 3-PHENYLALKYLOXY-2-PHENYL-PROPYLAMINES Boehringer Ingelheim Pharma KG (DE) 2001-11-21 EP disclosed
WO-2000048987-A1 NOVEL SUBSTITUTED 3-PHENOXY AND 3-PHENYLALKYLOXY-2-PHENYL-PROPYLAMINES BOEHRINGER INGELHEIM PHARMA KG (DE) 2000-08-24 WO disclosed
US-5731318-A NEUROLOGICAL DISORDERS BOEHRINGER INGELHEIM KG (DE) 1998-03-24 US disclosed
US-5607941-A BENZOMORPHAN DERIVATIVES BOEHRINGER INGELHEIM KG (DE) 1997-03-04 US disclosed
EP-0521422-B1 Benzomorphanes and their use as pharmaceuticals BOEHRINGER INGELHEIM KG (DE) 1996-05-08 EP disclosed
EP-0521422-A1 Benzomorphanes and their use as pharmaceuticals BOEHRINGER INGELHEIM KG (DE) 1993-01-07 EP disclosed
US-4845091-A HYPOTENSIVE AGENTS, VASCULAR DISORDERS CASSELLA AKTIENGESELLSCHAFT (DE) 1989-07-04 US disclosed
EP-0006449-B1 2-(2-ALKOXYETHYL)-2'-HYDROXY-6.7-BENZOMORPHANE DERIVATIVES, THEIR ACID ADDITION SALTS, MEDICAMENTS CONTAINING THEM AND PROCESS FOR THEIR PREPARATION C.H. BOEHRINGER SOHN (DE) 1982-12-08 EP disclosed
US-4293556-A Analgesic 2-(2-alkoxy-ethyl)-2'-hydroxy-6,7-benzomorphans and salts thereof BOEHRINGER INGELHEIM GMBH (DE) 1981-10-06 US disclosed
EP-0006449-A1 2-(2-Alkoxyethyl)-2'-hydroxy-6.7-benzomorphane derivatives, their acid addition salts, medicaments containing them and process for their preparation C.H. BOEHRINGER SOHN (DE) 1980-01-09 EP disclosed