SCHEMBL1150571

SCHEMBL1150571

CC(=O)OCC1C(C(=O)OC2CCCCC2)C1(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.38
EPHX1 P07099 2/20 0.37
CYP2C19 P33261 1/20 0.36
CYP19A1 P11511 2/20 0.34
HTT P42858 1/20 0.34
ALDH1A1 P00352 3/20 0.32
CYP3A4 P08684 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
FABP7 O15540 1/20 0.31
FABP5 Q01469 1/20 0.31
THRB P10828 1/20 0.31
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL20815369 0.86 NAAA (0.42) NAAAEPHX1CYP2C19CYP19A1HTT
SCHEMBL20815368 0.83 NAAA (0.47) NAAAEPHX1CYP2C19CYP19A1HTT
SCHEMBL2127188 0.81 CYP2C19 (0.42) NAAAEPHX1CYP2C19CYP19A1HTT
SCHEMBL1150245 0.79 CHRNB2 (0.45) HTTALDH1A1MEN1KMT2AFABP7
SCHEMBL1150190 0.79 LMNA (0.34) HTTALDH1A1
SCHEMBL295529 0.77 NAAA (0.38) NAAAEPHX1CYP2C19CYP19A1HTT
SCHEMBL27901906 0.76 FABP7 (0.43) ALDH1A1FABP7FABP5CHRM2CHRM4
SCHEMBL1685648 0.74 LMNA (0.51) HTTALDH1A1MAPTTSHR
SCHEMBL1150166 0.74 LMNA (0.51) HTTALDH1A1MAPTTSHR
SCHEMBL1150168 0.74 LMNA (0.51) HTTALDH1A1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2341042-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE CYCLOPROPANE CARBOXYLIC ACID ESTER COMPOUND, ASYMMETRIC COPPER COMPLEX, AND OPTICALLY ACTIVE SALICYLIDENEAMINOALCOHOL COMPOUND SUMITOMO CHEMICAL CO (JP) 2019-03-20 EP disclosed
CN-101506142-B Process for production of trans-2,2-dimethyl- 3-formylcyclopropane carboxylic acid ester SUMITOMO CO LTD 2013-04-17 CN disclosed
US-7893294-B2 Process for production of trans-2, 2-dimethyl-3-formylcyclopropanecarboxylic acid ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-02-22 US disclosed
US-20090314987-A1 PROCESS FOR PRODUCTION OF TRANS-2, 2-DIMETHYL-3-FORMYLCYCLOPROPANECARBOXYLIC ACID ESTER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-12-24 US disclosed
CN-101506142-A Process for production of trans-2,2-dimethyl- 3-formylcyclopropane carboxylic acid ester SUMITOMO CHEMICAL CO (JP) 2009-08-12 CN disclosed
EP-2053037-A1 PROCESS FOR PRODUCTION OF TRANS-2,2-DIMETHYL- 3-FORMYLCYCLOPROPANE CARBOXYLIC ACID ESTER Sumitomo Chemical Company, Limited (JP) 2009-04-29 EP disclosed