SCHEMBL7207341

SCHEMBL7207341

C=CC(C)(C)C(C(=O)OCC)C(=O)OCC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.37
LMNA P02545 2/20 0.36
HSD17B10 Q99714 1/20 0.36
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
SOAT1 P35610 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPSR1 Q6W5P4 2/20 0.33
MMP8 P22894 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
PKM P14618 1/20 0.33
CPB2 Q96IY4 1/20 0.33
TSHR P16473 1/20 0.32
GLO1 Q04760 1/20 0.32
TRPA1 O75762 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 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
SCHEMBL9796637 0.93 MGAM (0.34) ALDH1A1LMNAHSD17B10ALOX15MGAM
SCHEMBL9796908 0.90 ALDH1A1 (0.37) ALDH1A1LMNAHSD17B10ALOX15MGAM
SCHEMBL7208166 0.90 HCAR2 (0.34) ALDH1A1LMNAHSD17B10ALOX15MGAM
SCHEMBL9796655 0.86 SMN1; SMN2 (0.30) ALDH1A1SMN1; SMN2TSHR
SCHEMBL9796662 0.82 MMP8 (0.36) ALDH1A1LMNAHSD17B10ALOX15MGAM
SCHEMBL16237398 0.80 ALOX15 (0.37) ALDH1A1LMNAHSD17B10ALOX15MGAM
SCHEMBL10910007 0.79 MEN1 (0.47) ALDH1A1LMNAHSD17B10SMN1; SMN2NPSR1
SCHEMBL4337217 0.78 SMN1; SMN2 (0.36) SMN1; SMN2TSHRKMT2A
SCHEMBL2048461 0.76 SMN1; SMN2 (0.35) ALDH1A1LMNAHSD17B10ALOX15MGAM
SCHEMBL9796768 0.76 ALDH1A1 (0.38) ALDH1A1LMNAHSD17B10GAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3164409-A1 GROUP 8 TRANSITION METAL CATALYSTS AND METHOD FOR MAKING SAME AND PROCESS FOR USE OF SAME IN METATHESIS REACTION Guang Ming Innovation Company (Wuhan) (CN) 2017-05-10 EP disclosed
WO-2016000242-A1 GROUP 8 TRANSITION METAL CATALYSTS AND METHOD FOR MAKING SAME AND PROCESS FOR USE OF SAME IN METATHESIS REACTION GUANG MING INNOVATION COMPANY (WUHAN) (CN) 2016-01-07 WO disclosed
US-6613934-B1 Enzymatic partial hydrolysis of a diester of malonic acid DEGUSSA AG (DE) 2003-09-02 US disclosed
EP-0812819-B1 Enantiomer-enriched tertiary hydrocarbonrest-substituted malonic acid ester and the preparation DEGUSSA (DE) 2001-11-28 EP disclosed
EP-0812819-A2 Enantiomer-enriched tertiary hydrocarbonrest-substituted malonic acid ester and the preparation HÜLS AKTIENGESELLSCHAFT (DE) 1997-12-17 EP disclosed
EP-0163996-A1 2,2-Dimethyl-3-formylcyclopropanes and process for their preparation BAYER AG (DE) 1985-12-11 EP disclosed
EP-0059756-B1 7-OXOPROSTACYCLIN DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SCHERING AKTIENGESELLSCHAFT (DE) 1985-08-28 EP disclosed
US-4489092-A Prostanoic acid derivatives and their preparation SCHERING AKTIENGESELLSCHAFT (DE) 1984-12-18 US disclosed
US-4466969-A 7-Oxoprostacyclin derivatives and their use as hypotensives and bronchodilators SCHERING AKTIENGESELLSCHAFT (DE) 1984-08-21 US disclosed
US-4359467-A Prostanoic acid derivatives and their preparation SCHERING AKTIENGESELLSCHAFT (DE) 1982-11-16 US disclosed
EP-0059756-A1 7-OXOPROSTACYCLIN DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF. SCHERING AG (DE) 1982-09-15 EP disclosed
US-4334091-A Process for preparing halovinyl cyclopropane carboxylic acid salts AIR PRODUCTS AND CHEMICALS, INC. (US) 1982-06-08 US disclosed
WO-1982001002-A1 7-OXOPROSTACYCLIN DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF NICKOLSON R 1982-04-01 WO disclosed
US-4284646-A Prostanoic acid derivatives and their preparation SCHERING AKTIENGESELLSCHAFT (DE) 1981-08-18 US disclosed
US-4257975-A 4-Halo-3,3-dimethyl-6,6,6-trihalohexanoate intermediates IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1981-03-24 US disclosed
US-4198347-A 2(2,2-Dichlorovinyl)-3,3-dimethyl-cyclopropane carboxylates IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1980-04-15 US disclosed