SCHEMBL9503508

SCHEMBL9503508

C=CCOC(=O)C=C.O=C1CC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.43
ALDH1A1 P00352 5/20 0.43
TP53 P04637 3/20 0.43
HIF1A Q16665 3/20 0.43
CYP3A4 P08684 3/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPT P10636 1/20 0.43
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.39
MAPK1 P28482 1/20 0.39
HPGD P15428 1/20 0.39
APP P05067 1/20 0.39
THRB P10828 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PKM P14618 1/20 0.33
SNCA P37840 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL19273 0.87
SCHEMBL31267242 0.87 TSHR (0.54) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL5167665 0.87 TSHR (0.54) TSHRALDH1A1TP53HIF1ACYP3A4
Ethylene SCHEMBL5184263 0.84 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
Formaldehyde SCHEMBL22631565 0.84 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
Fluoride SCHEMBL2542918 0.84
Ethylene SCHEMBL461105 0.84 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
Charcoal, Activated SCHEMBL3744730 0.84
Water SCHEMBL1079113 0.84
SCHEMBL7154947 0.84

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
EP-0370735-B1 MANUFACTURE OF MODIFIED POLYPROPYLENE COMPOSITIONS USING NON-INTERMESHING TWIN SCREW EXTRUDER Du Pont Canada Inc. (CA) 1993-08-25 EP disclosed
EP-0370736-B1 METHOD FOR MANUFACTURE OF MODIFIED POLYPROPYLENE COMPOSITIONS Du Pont Canada Inc. (CA) 1993-06-23 EP disclosed
US-5137975-A Graft polymerization; melt grafting alpha,beta-unsaturated acid and anhydride in presence of organic peroxide as catalyst DU PONT CANADA INC. (CA) 1992-08-11 US disclosed
EP-0370736-A2 Method for manufacture of modified polypropylene compositions Du Pont Canada Inc. (CA) 1990-05-30 EP disclosed
EP-0370735-A2 Manufacture of modified polypropylene compositions using non-intermeshing twin screw extruder Du Pont Canada Inc. (CA) 1990-05-30 EP disclosed