SCHEMBL7763261

SCHEMBL7763261

C=CC(=O)OCC(C)(C)COCC(=C)C

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
TP53 P04637 3/20 0.44
HIF1A Q16665 3/20 0.44
CYP3A4 P08684 2/20 0.44
MAPK1 P28482 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
THRB P10828 1/20 0.41
TSHR P16473 7/20 0.40
HSD17B10 Q99714 1/20 0.40
HPGD P15428 1/20 0.37

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
SCHEMBL10523874 0.86 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL9576144 0.86 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL262028 0.84 ALDH1A1 (0.59) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL1072217 0.81 THRB (0.49) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL11682404 0.80 ALDH1A1 (0.52) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL8965511 0.80 TSHR (0.33) MAPK1TSHRHSD17B10
SCHEMBL2353139 0.79 ALDH1A1 (0.47) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL21252605 0.79 ALDH1A1 (0.47) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL2670062 0.79 ALDH1A1 (0.47) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL12862497 0.79 ALDH1A1 (0.50) ALDH1A1TP53HIF1ACYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0693002-B2 METHODS FOR PRODUCING HIGH GLOSS RADIATON CURABLE COATINGS PPG IND OHIO INC (US) 2001-05-02 EP disclosed
EP-0693002-B1 COMPOSITIONS AND METHODS FOR PRODUCING HIGH GLOSS RADIATON CURABLE COATINGS PPG INDUSTRIES INC (US) 1997-10-15 EP disclosed
US-5585415-A A FINE, UNIFORM SURFACE WRINKLING EFFECT; USING AN ACYLPHOSPHINE AND AN ACETOPHENONE DERIVATIVE AS PHOTOINITIATORS PPG INDUSTRIES, INC. (US) 1996-12-17 US disclosed
US-4229274-A PHOTOINITIATOR, PHOTOSENSITIZER, QUENCHER, AND COMPOUNDS CONTAINING ACRYLYLOXY GROUPS PPG INDUSTRIES, INC. (US) 1980-10-21 US disclosed
US-4170663-A PHOTOPOLYMERIZATION, CURING INTERIOR FIRST PPG INDUSTRIES, INC. (US) 1979-10-09 US disclosed
US-4097783-A Ultraviolet light processor PPG INDUSTRIES, INC. (US) 1978-06-27 US disclosed
US-4054683-A Pigmented actinic light polymerizable coating compositions containing phenanthrenequinone PPG INDUSTRIES, INC. (US) 1977-10-18 US disclosed
US-4048036-A CURING, PHOTOINITIATOR PPG INDUSTRIES, INC. (US) 1977-09-13 US disclosed
US-4037112-A Apparatus for crosslinking ultraviolet light curable coatings PPG INDUSTRIES, INC. (US) 1977-07-19 US disclosed
US-4024296-A Photocatalyst system and pigmented actinic light polymerizable coating compositions containing the same PPG INDUSTRIES, INC. (US) 1977-05-17 US disclosed
US-4005244-A Ultraviolet light curable opacifying compositions PPG INDUSTRIES, INC. (US) 1977-01-25 US disclosed
US-3984726-A Ultraviolet light system having means for maintaining constant intensity light profile PPG INDUSTRIES, INC. (US) 1976-10-05 US disclosed