SCHEMBL4783194

SCHEMBL4783194

CCCC(C)(C)OOC(C(=O)O)=C(C(=O)O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 2/20 0.37
CYP2D6 P10635 2/20 0.36
HTR1A P08908 1/20 0.36
SCN1A P35498 1/20 0.36
SLC6A3 Q01959 1/20 0.36
SCN5A Q14524 1/20 0.36
SCN2A Q99250 1/20 0.36
SCN3A Q9NY46 1/20 0.36
CES2 O00748 4/20 0.35
CES1 P23141 4/20 0.35
PRSS1 P07477 5/20 0.34
CTSG P08311 5/20 0.34
CTRB1 P17538 5/20 0.34
CMA1 P23946 5/20 0.34
CYP2C19 P33261 2/20 0.34
CYP1A2 P05177 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
SCHEMBL4783192 1.00 TDP1 (0.41) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL4733828 0.82 TSHR (0.61) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL4733821 0.82 TSHR (0.61) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL28733 0.80 TDP1 (0.64) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL28732 0.75 TDP1 (0.56) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL4732195 0.74 LMNA (0.42) TDP1ALDH1A1TSHRLMNACES2
SCHEMBL4732201 0.74 LMNA (0.42) TDP1ALDH1A1TSHRLMNACES2
SCHEMBL7907952 0.73 ALDH1A1 (0.46) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL43962 0.73 TDP1 (0.72) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL5001492 0.72 LMNA (0.30) HSD17B10LMNA

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
US-20080250739-A1 FOAMED PLASTIC STRUCTURES NOVA CHEMICALS INC. (US) 2008-10-16 US disclosed
WO-2008057705-A1 FOAMED PLASTIC STRUCTURES NOVA CHEMICALS INC. (US) 2008-05-15 WO disclosed
EP-0785964-B1 NON-LINEAR STYRENIC POLYMER-BASED FOAMS DOW CHEMICAL CO (US) 1999-04-14 EP disclosed
US-5830924-A LOW DENSITY CLOSED CELL, BLOWING AGENTS THE DOW CHEMICAL COMPANY (US) 1998-11-03 US disclosed
EP-0785957-B1 NON-LINEAR STYRENIC POLYMER COMPOSITIONS AND ARTICLES PREPARED THEREFROM DOW CHEMICAL CO (US) 1998-05-20 EP disclosed
EP-0785957-A1 NON-LINEAR STYRENIC POLYMER COMPOSITIONS AND ARTICLES PREPARED THEREFROM THE DOW CHEMICAL COMPANY (US) 1997-07-30 EP disclosed
WO-1996011962-A1 NON-LINEAR STYRENIC POLYMER COMPOSITIONS AND ARTICLES PREPARED THEREFROM THE DOW CHEMICAL COMPANY (US) 1996-04-25 WO disclosed