SCHEMBL6153149

SCHEMBL6153149

C=CCOC(=O)Oc1ccc(C=Cc2ccc(OC(=O)OCC=C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 1/20 0.51
APP P05067 2/20 0.44
KMT2A Q03164 4/20 0.44
CYP3A4 P08684 2/20 0.44
TP53 P04637 2/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 2/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
TTR P02766 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
SLC5A1 P13866 1/20 0.43
SLC5A2 P31639 1/20 0.43
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.41
FLT3 P36888 1/20 0.41
ALDH1A1 P00352 2/20 0.40
TSHR P16473 2/20 0.40

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
SCHEMBL10820448 0.92 TTR (0.56) SNCAAPPKMT2ACYP3A4TP53
SCHEMBL10870487 0.91 CYP3A4 (0.50) SNCAAPPKMT2ACYP3A4TP53
SCHEMBL9700576 0.90 CYP3A4 (0.43) SNCAAPPKMT2ACYP3A4TP53
SCHEMBL9816881 0.88 KMT2A (0.51) SNCAAPPKMT2ACYP3A4KDM4E
SCHEMBL6152948 0.86 CYP3A4 (0.46) SNCAKMT2ACYP3A4KDM4EMEN1
SCHEMBL9717273 0.84 ALDH1A1 (0.48) APPCYP3A4TP53KDM4EMAPT
SCHEMBL7946937 0.84 CYP3A4 (0.44) SNCAAPPKMT2ACYP3A4KDM4E
SCHEMBL9174753 0.83 CYP3A4 (0.43) KMT2ACYP3A4MEN1LMNAMAPT
SCHEMBL6152601 0.83 ELANE (0.49) SNCACYP3A4LMNAMAPTSMN1; SMN2
SCHEMBL6151946 0.83 ELANE (0.46) SNCAAPPKMT2ACYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1196466-B1 POLYMERIZABLE COMPOSITION OF ALIPHATIC POLYOL (ALLYL CARBONATE) PPG IND OHIO INC (US) 2005-01-26 EP disclosed
US-6316570-B1 FOR PRODUCING POLYMERIZATES HAVING CLARITY, GOOD FLEXIBILITY, ABRASION RESISTANCE WHICH ARE USED IN PREPARATION OF MOLDED ARTICLES SUCH AS LENSES PPG INDUSTRIES OHIO, INC. 2001-11-13 US disclosed