SCHEMBL3336159

SCHEMBL3336159

CC(C)(C)OOC(C)(C)C.CCCCCC(=O)OCC(CC)CCCC

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.79
CYP3A4 P08684 2/20 0.79
ATM Q13315 1/20 0.79
TDP1 Q9NUW8 1/20 0.79
LMNA P02545 2/20 0.53
ALDH1A1 P00352 2/20 0.53
RECQL P46063 1/20 0.51
MAPT P10636 1/20 0.50
KDM4E B2RXH2 1/20 0.48
DUSP3 P51452 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
CA2 P00918 1/20 0.47
PRKCA P17252 1/20 0.46
PRKCE Q02156 1/20 0.46
PRKCQ Q04759 1/20 0.46
PRKCD Q05655 1/20 0.46
DGKA P23743 1/20 0.45
PRSS1 P07477 1/20 0.45
PRSS2 P07478 1/20 0.45

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
SCHEMBL247560 0.91 TSHR (0.96) TSHRCYP3A4ATMTDP1LMNA
SCHEMBL153398 0.89 TSHR (0.93) TSHRCYP3A4ATMTDP1LMNA
SCHEMBL9986005 0.89 TSHR (0.93) TSHRCYP3A4ATMTDP1LMNA
SCHEMBL333145 0.89 TSHR (0.93) TSHRCYP3A4ATMTDP1LMNA
SCHEMBL4625908 0.89 TSHR (0.93) TSHRCYP3A4ATMTDP1LMNA
SCHEMBL11412640 0.89 TSHR (0.93) TSHRCYP3A4ATMTDP1LMNA
SCHEMBL3225069 0.89 TSHR (0.93) TSHRCYP3A4ATMTDP1LMNA
SCHEMBL55305 0.89 TSHR (0.93) TSHRCYP3A4ATMTDP1LMNA
SCHEMBL9229154 0.89 TSHR (0.93) TSHRCYP3A4ATMTDP1LMNA
SCHEMBL29202797 0.89 TSHR (0.93) TSHRCYP3A4ATMTDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268902-B2 Composite material based on vinylaromatic polymers having enhanced thermal insulation properties and process for the preparation thereof POLIMERI EUROPA S.P.A. (IT) 2012-09-18 US disclosed
US-20100148110-A1 COMPOSITE MATERIAL BASED ON VINYLAROMATIC POLYMERS HAVING ENHANCED THERMAL INSULATION PROPERTIES AND PROCESS FOR THE PREPARATION THEREOF POLIMERI EUROPA S.P.A. (IT) 2010-06-17 US disclosed
WO-2008141767-A2 COMPOSITE MATERIAL BASED ON VINYL AROMATIC POLYMERS HAVING ENHANCED THERMAL INSULATION PROPERTIES AND PROCESS FOR THE PREPARATION THEREOF POLIMERI EUROPA S.P.A. (IT) 2008-11-27 WO disclosed