SCHEMBL5052084

SCHEMBL5052084

CCCCOCCCCOC(=O)c1ccccc1C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.76
L3MBTL1 Q9Y468 3/20 0.76
TDP1 Q9NUW8 3/20 0.76
MAPK1 P28482 3/20 0.73
CYP3A4 P08684 2/20 0.73
TP53 P04637 1/20 0.73
ALDH1A1 P00352 10/20 0.71
LMNA P02545 3/20 0.71
HSD17B10 Q99714 2/20 0.61
KDM4E B2RXH2 4/20 0.58
POLB P06746 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
PPARA Q07869 1/20 0.49
GPR35 Q9HC97 1/20 0.49
PTPN11 Q06124 1/20 0.49

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
SCHEMBL14672550 0.94 TSHR (0.71) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL1919907 0.94 TSHR (0.71) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL31426841 0.94 TSHR (0.71) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL29649180 0.94 TSHR (0.86) TSHRL3MBTL1TDP1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL2220638 0.94 TSHR (0.86) TSHRL3MBTL1TDP1MAPK1CYP3A4
SCHEMBL151027 0.94 TSHR (0.86) TSHRL3MBTL1TDP1MAPK1CYP3A4
Benzene SCHEMBL3679548 0.94 TSHR (0.86) TSHRL3MBTL1TDP1MAPK1CYP3A4
Dibutyl Phthalate SCHEMBL27849163 0.94 TSHR (0.86) TSHRL3MBTL1TDP1MAPK1CYP3A4
Phthalic Acid SCHEMBL27849166 0.94 TSHR (0.86) TSHRL3MBTL1TDP1MAPK1CYP3A4
Phthalic Acid SCHEMBL28643359 0.92 ALDH1A1 (0.84) TSHRL3MBTL1TDP1MAPK1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7396425-B2 Method of production of peeling layer paste and method of production of multilayer type electronic device TDK CORPORATION (JP) 2008-07-08 US disclosed
US-20060037690-A1 Method of production of peeling layer paste and method of production of a multilayer type electronic device TDK CORPORATION (JP) 2006-02-23 US disclosed
US-4427809-A Thermoplastic moulding compositions of co-graft polymers BAYER AKTIENGESELLSCHAFT (DE) 1984-01-24 US disclosed
US-4368292-A ACRYLIC ESTER, VINYL ESTER; TOUGHNESS, FLEXIBILITY BAYER AKTIENGESELLSCHAFT (DE) 1983-01-11 US disclosed