SCHEMBL18113253

SCHEMBL18113253

CCOC(=O)C(C)SC(C)=S

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP2D6 P10635 1/20 0.38
KDM4E B2RXH2 3/20 0.37
TP53 P04637 1/20 0.37
TDP1 Q9NUW8 2/20 0.35
MAPT P10636 2/20 0.35
HTT P42858 1/20 0.35
ALOX15 P16050 2/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 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

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
SCHEMBL12254969 0.86 ALDH1A1 (0.40) ALDH1A1HPGDLMNAHSD17B10CYP2D6
SCHEMBL238094 0.83 ALDH1A1 (0.47) ALDH1A1HPGDLMNAHSD17B10CYP2D6
SCHEMBL18113151 0.83 ALDH1A1 (0.44) ALDH1A1HPGDLMNAHSD17B10KDM4E
SCHEMBL11063755 0.83 ALDH1A1 (0.44) ALDH1A1HPGDLMNAHSD17B10KDM4E
SCHEMBL5935950 0.80 ALDH1A1 (0.40) ALDH1A1HPGDLMNAHSD17B10CYP2D6
SCHEMBL9528966 0.80 ALDH1A1 (0.40) ALDH1A1HPGDLMNAHSD17B10CYP2D6
SCHEMBL13873965 0.80 ALDH1A1 (0.36) ALDH1A1
SCHEMBL10748327 0.79 ALDH1A1 (0.41) ALDH1A1HPGDLMNAHSD17B10KDM4E
SCHEMBL20398185 0.79 ALDH1A1 (0.39) ALDH1A1HPGDLMNAHSD17B10CYP2D6
SCHEMBL5935910 0.79 NPSR1 (0.39) ALDH1A1HPGDLMNAHSD17B10CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3277736-B1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA SRL (IT) 2019-03-27 EP disclosed
US-10011668-B2 Catalyst components for the polymerization of olefins BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-07-03 US disclosed
US-20180057622-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2018-03-01 US disclosed
EP-3277736-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS Basell Poliolefine Italia S.r.l. (IT) 2018-02-07 EP disclosed
WO-2016156473-A1 CATALYST COMPONENTS FOR THE POLYMERIZATION OF OLEFINS BASELL POLIOLEFINE ITALIA S.R.L. (IT) 2016-10-06 WO disclosed