SCHEMBL3397602

SCHEMBL3397602

CCCC(CC(=O)OC)C(C(=O)OC)C(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
ZDHHC7 Q9NXF8 1/20 0.42
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 3/20 0.34
BIRC2 Q13490 3/20 0.33
HDAC7 Q8WUI4 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
MGAM O43451 2/20 0.32
GAA P10253 2/20 0.32
SI P14410 2/20 0.32
MGAM2 Q2M2H8 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TET2 Q6N021 1/20 0.31
CHRM1 P11229 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
SCHEMBL3392795 1.00 SMN1; SMN2 (0.45) SMN1; SMN2ZDHHC7CA1CA2USP2
SCHEMBL3392732 0.89 GAA (0.43) SMN1; SMN2ZDHHC7CA1CA2TSHR
SCHEMBL3395546 0.89 GAA (0.43) SMN1; SMN2ZDHHC7CA1CA2TSHR
SCHEMBL3395840 0.89 MGAM (0.39) SMN1; SMN2ZDHHC7CA1CA2LMNA
SCHEMBL3395204 0.89 MGAM (0.39) SMN1; SMN2ZDHHC7CA1CA2LMNA
SCHEMBL3391894 0.84 SMN1; SMN2 (0.48) SMN1; SMN2ZDHHC7CA1CA2USP2
SCHEMBL3395527 0.84 SMN1; SMN2 (0.48) SMN1; SMN2ZDHHC7CA1CA2USP2
SCHEMBL25637688 0.80 ZDHHC7 (0.44) SMN1; SMN2ZDHHC7CA1CA2USP2
SCHEMBL3392348 0.77 MGAM (0.41) LMNATSHRMGAMGAASI
SCHEMBL3392227 0.77 MGAM (0.41) LMNATSHRMGAMGAASI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2154253-B1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYL-1,1,3-TRIALKOXYCARBONYLPROPANE SUMITOMO CHEMICAL CO (JP) 2019-04-10 EP disclosed
US-9970043-B2 Process for producing optically active 2-alkyl-1,1,3-trialkoxycarbonylpropane GENENTECH, INC. (US) 2018-05-15 US disclosed
US-20170145468-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYL-1,1,3-TRIALKOXYCARBONYLPROPANE GENENTECH, INC. (US) 2017-05-25 US disclosed
US-20150218602-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYL-1,1,3-TRIALKOXYCARBONYLPROPANE GENENTECH INC (US) 2015-08-06 US disclosed
US-8969051-B2 Process for producing optically active 2-alkyl-1,1,3-trialkoxycarbonylpropane SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-03-03 US disclosed
US-20100240107-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYL-1,1,3-TRIALKOXYCARBONYLPROPANE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-23 US disclosed
EP-2154253-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 2-ALKYL-1,1,3-TRIALKOXYCARBONYLPROPANE Sumitomo Chemical Company, Limited (JP) 2010-02-17 EP disclosed