SCHEMBL3391894

SCHEMBL3391894

CCC(CC(=O)OC)C(C(=O)OC)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
TSHR P16473 4/20 0.37
MGAM O43451 2/20 0.34
GAA P10253 2/20 0.34
SI P14410 2/20 0.34
MGAM2 Q2M2H8 2/20 0.34
HSD17B10 Q99714 1/20 0.34
ZDHHC7 Q9NXF8 1/20 0.32
BIRC2 Q13490 1/20 0.31
USP2 O75604 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 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
SCHEMBL3395527 1.00 SMN1; SMN2 (0.48) SMN1; SMN2CA1CA2TSHRMGAM
SCHEMBL3392820 0.88 GAA (0.46) SMN1; SMN2CA1CA2TSHRMGAM
SCHEMBL3394079 0.88 MGAM (0.41) SMN1; SMN2CA1CA2TSHRMGAM
SCHEMBL3394073 0.88 MGAM (0.41) SMN1; SMN2CA1CA2TSHRMGAM
SCHEMBL3392817 0.88 GAA (0.46) SMN1; SMN2CA1CA2TSHRMGAM
SCHEMBL3397370 0.85 CA1 (0.34) SMN1; SMN2CA1CA2TSHRMGAM
SCHEMBL3396403 0.85 CA1 (0.34) SMN1; SMN2CA1CA2TSHRMGAM
SCHEMBL677361 0.84 TSHR (0.46) SMN1; SMN2CA1CA2TSHRMGAM
SCHEMBL3397602 0.84 SMN1; SMN2 (0.45) SMN1; SMN2CA1CA2TSHRMGAM
SCHEMBL3392795 0.84 SMN1; SMN2 (0.45) SMN1; SMN2CA1CA2TSHRMGAM

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