SCHEMBL2328532

SCHEMBL2328532

CC1CC(OC(=O)O)CCC1(C)OC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.31
LMNA P02545 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL11499512 0.73 CYP3A4 (0.30)
SCHEMBL3267324 0.73 SCN1A (0.30)
SCHEMBL27896935 0.72 ALOX15 (0.34) ALOX15LMNA
SCHEMBL16610483 0.70 APLNR (0.34) LMNATDP1
SCHEMBL15520040 0.69
SCHEMBL8638066 0.69 CYP2C19 (0.32)
SCHEMBL23751421 0.67 FFAR3 (0.52) LMNA
SCHEMBL6663027 0.67 CYP2C19 (0.34)
SCHEMBL19592470 0.67 ALDH1A1 (0.43) ALOX15LMNATDP1
SCHEMBL906168 0.66 SERPINE1 (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2356098-A1 PROCESS FOR PREPARING TETRAHYDROFURAN BASF SE (DE) 2011-08-17 EP claimed
EP-1515932-B1 METHOD FOR THE PRODUCTION OF 1,4- BUTANEDIOL BASF SE (DE) 2010-06-16 EP claimed
WO-2010054976-A1 PROCESS FOR PREPARING TETRAHYDROFURAN BASF SE (DE) 2010-05-20 WO claimed
JP-4418746-B2 2010-02-24 JP claimed
JP-2005534657-A 2005-11-17 JP claimed
JP-2005533776-A 2005-11-10 JP claimed
EP-1515932-A1 METHOD FOR THE PRODUCTION OF 1,4- BUTANEDIOL BASF AKTIENGESELLSCHAFT (DE) 2005-03-23 EP claimed
EP-1515935-A1 METHOD FOR THE PRODUCTION OF 1,4- BUTANE-DIOL BY COMBINED GAS-PHASE AND LIQUID-PHASE HYDROGENATION BASF AKTIENGESELLSCHAFT (DE) 2005-03-23 EP claimed
EP-1515933-A1 TWO-STAGE METHOD FOR PRODUCING BUTANE DIOL WITH INTERMEDIATE SEPARATION OF SUCCINIC ANHYDRIDE BASF AKTIENGESELLSCHAFT (DE) 2005-03-23 EP claimed
EP-1343743-B1 METHOD FOR THE PRODUCTION OF TETRAHYDROFURAN BASF AG (DE) 2004-09-22 EP claimed
WO-2003104174-A1 METHOD FOR THE PRODUCTION OF 1,4- BUTANEDIOL BASF AKTIENGESELLSCHAFT (DE) 2003-12-18 WO claimed
WO-2003104176-A1 METHOD FOR THE PRODUCTION OF 1,4- BUTANE-DIOL BY COMBINED GAS-PHASE AND LIQUID-PHASE HYDROGENATION BASF AKTIENGESELLSCHAFT (DE) 2003-12-18 WO claimed
WO-2003104175-A1 TWO-STAGE METHOD FOR PRODUCING BUTANE DIOL WITH INTERMEDIATE SEPARATION OF SUCCINIC ANHYDRIDE BASF AKTIENGESELLSCHAFT (DE) 2003-12-18 WO claimed
WO-2003104214-A2 TWO-STAGE METHOD FOR PRODUCING BUTANDIOL IN TWO REACTORS BASF AKTIENGESELLESCHAFT (DE) 2003-12-18 WO claimed
EP-1343743-A2 METHOD FOR THE PRODUCTION OF TETRAHYDROFURAN BASF AKTIENGESELLSCHAFT (DE) 2003-09-17 EP claimed
WO-2002048128-A2 METHOD FOR THE PRODUCTION OF TETRAHYDROFURAN BASF AKTIENGESELLSCHAFT (DE) 2002-06-20 WO claimed
EP-1694662-B1 Method for the production of defined mixtures of THF, BDO and GBL by gas phase hydrogenation BASF SE (DE) 2012-09-05 EP disclosed
EP-1515932-B1 METHOD FOR THE PRODUCTION OF 1,4- BUTANEDIOL BASF SE (DE) 2010-06-16 EP disclosed
WO-2003104174-A1 METHOD FOR THE PRODUCTION OF 1,4- BUTANEDIOL BASF AKTIENGESELLSCHAFT (DE) 2003-12-18 WO disclosed
WO-2003093256-A1 METHOD FOR PRODUCING GAMMA-BUTYROLACTONE BASF AKTIENGESELLSCHAFT (DE) 2003-11-13 WO disclosed