SCHEMBL767076

SCHEMBL767076

CC(C)(C)OC(=O)NC(c1ccccc1)C(O)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.51
CTSS P25774 2/20 0.51
GABRB1 P18505 1/20 0.45
GABRB2 P47870 1/20 0.45
MAPT P10636 1/20 0.45
PPARA Q07869 5/20 0.45
PPARG P37231 4/20 0.45
ATM Q13315 1/20 0.45
ACE P12821 1/20 0.44
PPARD Q03181 2/20 0.43

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
SCHEMBL335777 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL8886861 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL13363641 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL144832 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL6166 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL12070284 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
SCHEMBL7087412 1.00 CTSK (0.51) CTSKCTSSGABRB1GABRB2MAPT
Water SCHEMBL7774670 0.98 CTSK (0.53) CTSKCTSSGABRB1GABRB2MAPT
Water SCHEMBL8011422 0.98 CTSK (0.53) CTSKCTSSGABRB1GABRB2MAPT
Water SCHEMBL766860 0.98 CTSK (0.53) CTSKCTSSGABRB1GABRB2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108976181-A A kind of preparation method of amorphous Cabazitaxel 江苏红豆杉药业有限公司 2018-12-11 CN claimed
EP-2247582-A2 CRYSTALLINE FORMS OF DIMETHOXY DOCETAXEL AND METHODS FOR PREPARING SAME Aventis Pharma S.A. (FR) 2010-11-10 EP claimed
WO-2009115655-A2 CRYSTALLINE FORMS OF DIMETHOXY DOCETAXEL AND METHODS FOR PREPARING SAME AVENTIS PHARMA S.A. (FR) 2009-09-24 WO claimed
EP-1694660-B1 PROCESS FOR THE PREPARATION OF ANHYDROUS AND HYDRATED ACTIVE PHARMACEUTICAL INGREDIENTS (APIS); STABLE PHARMACEUTICAL COMPOSITIONS PREPARED FROM THE SAME AND USES OF SAID COMPOSITIONS QUIRAL QUIMICA DO BRASIL (BR) 2009-04-08 EP claimed
CN-111201223-B Octahydrocyclopenta [ c ] pyrrole allosteric inhibitors of SHP2 克鲁松制药公司 2024-07-09 CN disclosed
CN-118021814-A Combination therapy with EHMT2 inhibitors EPIZYME股份有限公司 2024-05-14 CN disclosed
CN-110621316-B Combination therapy with EHMT2 inhibitors EPIZYME股份有限公司 2024-01-26 CN disclosed
EP-4293105-A1 MATURATION AGENT Orizuru Therapeutics, Inc. (JP) 2023-12-20 EP disclosed
CN-113636956-A Preparation method of docetaxel chiral side chain intermediate 深圳市老年医学研究所 2021-11-12 CN disclosed
EP-3755699-A1 SHP2 PHOSPHATASE INHIBITORS AND METHODS OF USE THEREOF Relay Therapeutics, Inc. (US) 2020-12-30 EP disclosed
CN-111718316-A Production process of docetaxel trihydrate 无锡紫杉药业有限公司 2020-09-29 CN disclosed
EP-3687997-A1 PYRAZOLO[3,4-B]PYRAZINE DERIVATIVES AS SHP2 PHOSPHATASE INHIBITORS Relay Therapeutics, Inc. (US) 2020-08-05 EP disclosed
WO-2000009120-A1 NEW USE OF TAXOID DERIVATIVES AVENTIS PHARMA S.A. (FR) 2000-02-24 WO disclosed
EP-0876361-A1 4,10$g(b)-DIACETOXY-2$g(a)-BENZOYLOXY-5$g(b),20-EPOXY-1-HYDROXY-9-OXO-19-NOR-CYCLOPROPA G]TAX-11-ENE-13$g(a)-YL (2R,3S)-TERT-BUTOXYCARBONYLAMINO-2-HYDROXY-3-PHENYLPROPIONATE DIHYDRATE, AND METHOD FOR PREPARING SAME Aventis Pharma S.A. (FR) 1998-11-11 EP disclosed
US-5654449-A Taxoids, their preparation and the pharmaceutical compositions which contain them RHONE-POULENC RORER S.A. (FR) 1997-08-05 US disclosed
WO-1997021695-A1 4,10β-DIACETOXY-2α-BENZOYLOXY-5β,20-EPOXY-1-HYDROXY-9-OXO-19-NOR-CYCLOPROPA[G]TAX-11-ENE-13α-YL (2R,3S)-TERT-BUTOXYCARBONYLAMINO-2-HYDROXY-3-PHENYLPROPIONATE DIHYDRATE, AND METHOD FOR PREPARING SAME RHONE-POULENC RORER S.A. (FR) 1997-06-19 WO disclosed
EP-0770070-A1 METHOD FOR PREPARING 4-ACETOXY-2ALPHA-BENZOYLOXY-5ALPHA,20-EPOXY-1,7BETA,10BETA-TRIHYDROXY-9-OXO-TAX-11-EN-13ALPHA-YL(2R,3S)-3-TERT-BUTOXYCARBONYLAMINO-2-HYDROXY-3-PHENYLPROPIONATE TRIHYDRATE Aventis Pharma S.A. (FR) 1997-05-02 EP disclosed
EP-0703909-A1 $g(D)?6,7 -TAXOLS ANTINEOPLASTIC USE AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PHARMACIA & UPJOHN COMPANY (US) 1996-04-03 EP disclosed
WO-1996001815-A1 METHOD FOR PREPARING 4-ACETOXY-2α-BENZOYLOXY-5β,20-EPOXY-1,7β,10β-TRIHYDROXY-9-OXO-TAX-11-EN-13α-YL(2R,3S)-3-TERT-BUTOXYCARBONYLAMINO-2-HYDROXY-3-PHENYLPROPIONATE TRIHYDRATE RHONE-POULENC RORER S.A. (FR) 1996-01-25 WO disclosed
US-5476954-A Condensing hydroxyl protected taxane derivative with oxazolidine derivative, decyclizing in acid medium, reacting butoxycarbonyl or benzoyl radical with amine, deprotecting, isolating, purifying product RHONE-POULENC RORER S.A. (FR) 1995-12-19 US disclosed