SCHEMBL9470504

SCHEMBL9470504

CC(C)COC(=O)CS.CC(C)COC(=O)CS.CCCC[Sn]CCCC

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
TSHR P16473 4/20 0.36
LMNA P02545 4/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
ATM Q13315 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.35
DUSP3 P51452 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PRKCA P17252 2/20 0.33
PRKCE Q02156 2/20 0.33
PRKCQ Q04759 2/20 0.33
PRKCD Q05655 2/20 0.33
DGKA P23743 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL11545701 0.89 MAPT (0.37) MAPTTSHRLMNAALDH1A1CYP3A4
SCHEMBL11548578 0.82 DGKA (0.47) TSHRLMNAALDH1A1CYP3A4ATM
SCHEMBL10796247 0.82 MAPT (0.35) MAPTTSHRLMNAALDH1A1CYP3A4
SCHEMBL16389873 0.82 TSHR (0.46) MAPTTSHRALDH1A1TDP1KDM4E
SCHEMBL2136463 0.82
SCHEMBL1684087 0.81 CYP3A4 (0.60) TSHRLMNAALDH1A1CYP3A4ATM
SCHEMBL28449038 0.81 CYP3A4 (0.60) TSHRLMNAALDH1A1CYP3A4ATM
SCHEMBL9470931 0.81 MAPT (0.41) MAPTTSHRLMNAALDH1A1CYP3A4
SCHEMBL22091877 0.80 NAAA (0.44) TSHRDGKA
SCHEMBL338603 0.80 NAAA (0.44) TSHRDGKA

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
US-5244995-A Vinyl halide aqueous polymerization dispersant system THE BF GOODRICH COMPANY (US) 1993-09-14 US disclosed
US-5155189-A Derived from repeating units of acrylic and/or methacrylic ester polymers THE B. F. GOODRICH COMPANY (US) 1992-10-13 US disclosed
EP-0501300-A1 High melt flow crosslinked PVC resin, compound and articles derived therefrom The Geon Company (US) 1992-09-02 EP disclosed
EP-0483051-A1 Improved vinyl halide aqueous polymerization dispersant system The Geon Company (US) 1992-04-29 EP disclosed
EP-0473915-A1 Improved barrier PVC resins, compounds and articles derived therefrom THE B.F. GOODRICH COMPANY (US) 1992-03-11 EP disclosed