SCHEMBL8600478

SCHEMBL8600478

COCCC1CCOC1=O

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
KCNH3 Q9ULD8 1/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2C9 P11712 1/20 0.32
MAPK1 P28482 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL8763018 0.80 CYP1A2 (0.37) CYP1A2
SCHEMBL8762979 0.80 FKBP1A (0.32) KCNH3CYP1A2
SCHEMBL5599002 0.80
SCHEMBL3598980 0.79 ALDH1A1 (0.35) MAPK1
SCHEMBL6713075 0.78 KCNH3 (0.31) KCNH3CYP1A2
SCHEMBL20715353 0.78
SCHEMBL29152239 0.78
SCHEMBL576482 0.78
SCHEMBL6256848 0.77 KCNH3 (0.33) KCNH3CYP1A2
SCHEMBL8763009 0.76 KDM4E (0.36) CYP1A2CYP2C9MAPK1CYP2C19

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0584663-B1 Process for the preparation of tetrahydropyran-4-carboxylic acid and his esters BASF AG (DE) 1998-02-25 EP claimed
US-5466831-A Preparation of 3-(2-acyloxyethyl)-dihydro-2(3H)furanones BASF AKTIENGESELLSCHAFT (DE) 1995-11-14 US claimed
US-5371246-A Preparation of tetrahydropyran-4-carboxylic acid and esters thereof BASF AKTIENGESELLSCHAFT (DE) 1994-12-06 US claimed
EP-0584663-A2 Process for the preparation of tetrahydropyran-4-carboxylic acid and his esters BASF Aktiengesellschaft (DE) 1994-03-02 EP claimed
EP-0584663-B1 Process for the preparation of tetrahydropyran-4-carboxylic acid and his esters BASF AG (DE) 1998-02-25 EP disclosed
EP-0584631-B1 Process of preparing 3-(2'-acyloxyethyl)-dihydro-2(3H)furanones BASF AG (DE) 1997-07-16 EP disclosed
US-5580994-A Preparation of tetrahydropyran-4-carboxylic acid and its esters BASF AKTIENGESELLSCHAFT (DE) 1996-12-03 US disclosed
EP-0678091-B1 METHOD OF PREPARING TETRAHYDROPYRAN-4-CARBOXYLIC ACID AND ITS ESTERS BASF AG (DE) 1996-11-06 EP disclosed
US-5466831-A Preparation of 3-(2-acyloxyethyl)-dihydro-2(3H)furanones BASF AKTIENGESELLSCHAFT (DE) 1995-11-14 US disclosed
EP-0678091-A1 METHOD OF PREPARING TETRAHYDROPYRAN-4-CARBOXYLIC ACID AND ITS ESTERS. BASF AG (DE) 1995-10-25 EP disclosed
US-5371246-A Preparation of tetrahydropyran-4-carboxylic acid and esters thereof BASF AKTIENGESELLSCHAFT (DE) 1994-12-06 US disclosed
WO-1994015931-A1 METHOD OF PREPARING TETRAHYDROPYRAN-4-CARBOXYLIC ACID AND ITS ESTERS BASF AKTIENGESELLSCHAFT (DE) 1994-07-21 WO disclosed
EP-0584663-A2 Process for the preparation of tetrahydropyran-4-carboxylic acid and his esters BASF Aktiengesellschaft (DE) 1994-03-02 EP disclosed
EP-0584631-A1 Process of preparing 3-(2'-acyloxyethyl)-dihydro-2(3H)furanones BASF Aktiengesellschaft (DE) 1994-03-02 EP disclosed