SCHEMBL529079

SCHEMBL529079

O=C(OCC1CO1)C(CC1CO1)=C(c1ccccc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.47
ALDH1A1 P00352 1/20 0.43
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL28048609 0.84 TSHR (0.40) MGLLALDH1A1TDP1
SCHEMBL88384 0.81 ALDH1A1 (0.51) MGLLALDH1A1TDP1
SCHEMBL4441961 0.78 ALDH1A1 (0.54) MGLLALDH1A1TDP1
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL21245419 0.77 NPC1 (0.56) MGLLTDP1
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL14570069 0.77 NPC1 (0.56) MGLLTDP1
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL133986 0.77 NPC1 (0.56) MGLLTDP1
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL5604855 0.77 NPC1 (0.56) MGLLTDP1
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL6359889 0.75 NPC1 (0.55) MGLLTDP1
Benzoic Acid 2,3-Epoxypropyl Ester SCHEMBL6358027 0.74 CHRNB2 (0.55) MGLLTDP1
Benzophenone SCHEMBL11799146 0.73 ALDH1A1 (0.69) MGLLALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9102868-B2 Elastomer-modified crosslinked epoxy vinyl ester particles and methods for making and using the same 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-08-11 US claimed
US-20130126161-A1 ELASTOMER-MODIFIED CROSSLINKED EPOXY VINYL ESTER PARTICLES AND METHODS FOR MAKING AND USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-05-23 US claimed
US-9102868-B2 Elastomer-modified crosslinked epoxy vinyl ester particles and methods for making and using the same 3M INNOVATIVE PROPERTIES COMPANY (US) 2015-08-11 US disclosed
EP-2598558-A2 CROSSLINKED EPOXY VINYL ESTER PARTICLES AND METHODS FOR MAKING AND USING THE SAME 3M Innovative Properties Company (US) 2013-06-05 EP disclosed
EP-2598600-A1 ELASTOMER-MODIFIED CROSSLINKED EPOXY VINYL ESTER PARTICLES AND METHODS FOR MAKING AND USING THE SAME 3M Innovative Properties Company (US) 2013-06-05 EP disclosed
US-20130126160-A1 CROSSLINKED EPOXY VINYL ESTER PARTICLES AND METHODS FOR MAKING AND USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-05-23 US disclosed
US-20130126161-A1 ELASTOMER-MODIFIED CROSSLINKED EPOXY VINYL ESTER PARTICLES AND METHODS FOR MAKING AND USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-05-23 US disclosed
WO-2012015857-A2 CROSSLINKED EPOXY VINYL ESTER PARTICLES AND METHODS FOR MAKING AND USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-02-02 WO disclosed
WO-2012015860-A1 ELASTOMER-MODIFIED CROSSLINKED EPOXY VINYL ESTER PARTICLES AND METHODS FOR MAKING AND USING THE SAME 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-02-02 WO disclosed