SCHEMBL7141086

SCHEMBL7141086

C=CC(=O)OC(=O)C=Cc1ccco1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.57
POLB P06746 9/20 0.52
L3MBTL1 Q9Y468 4/20 0.52
ALDH1A1 P00352 2/20 0.52
CACNA1B Q00975 1/20 0.52
APBA1 Q02410 1/20 0.52
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
NPC1 O15118 1/20 0.51
BLM P54132 1/20 0.51
MCL1 Q07820 1/20 0.51
TDP1 Q9NUW8 5/20 0.49
APEX1 P27695 2/20 0.49
MAPT P10636 2/20 0.49
KDM4E B2RXH2 1/20 0.49
RAB9A P51151 1/20 0.49
MASP2 O00187 1/20 0.49
F2 P00734 1/20 0.49
CTDSP1 Q9GZU7 2/20 0.48
APOBEC3A P31941 1/20 0.48

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
SCHEMBL7141082 0.92 HCAR2 (0.67) HCAR2POLBL3MBTL1ALDH1A1CACNA1B
SCHEMBL7141083 0.92 HCAR2 (0.67) HCAR2POLBL3MBTL1ALDH1A1CACNA1B
SCHEMBL14275347 0.84 POLB (0.68) HCAR2POLBL3MBTL1ALDH1A1CACNA1B
SCHEMBL7903344 0.83 L3MBTL1 (0.59) HCAR2POLBL3MBTL1ALDH1A1CACNA1B
SCHEMBL5791207 0.82 HCAR2 (0.59) HCAR2POLBL3MBTL1ALDH1A1CACNA1B
SCHEMBL5791203 0.82 HCAR2 (0.59) HCAR2POLBL3MBTL1ALDH1A1CACNA1B
SCHEMBL7892508 0.81 ALDH1A1 (0.56) HCAR2POLBL3MBTL1ALDH1A1CACNA1B
SCHEMBL28993560 0.80 HCAR2 (0.65) HCAR2POLBL3MBTL1ALDH1A1KMT2A
SCHEMBL1408805 0.80 HCAR2 (0.65) HCAR2POLBL3MBTL1ALDH1A1CACNA1B
SCHEMBL6300803 0.78 HCAR2 (0.54) HCAR2POLBL3MBTL1ALDH1A1CACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6506863-B2 Used as crosslinking agents for olefin polymers BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2003-01-14 US claimed
US-20020137881-A1 Esters of 3-(2-furyl)-2propenoic acid with diols BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2002-09-26 US claimed
EP-1216999-A1 Esters of the 3-(2-furyl)-2-propenoic acid with diols Basell Poliolefine Italia S.p.A. (IT) 2002-06-26 EP claimed
US-6506863-B2 Used as crosslinking agents for olefin polymers BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2003-01-14 US disclosed
US-20020137881-A1 Esters of 3-(2-furyl)-2propenoic acid with diols BASELL POLIOLEFINE ITALIA S.P.A. (IT) 2002-09-26 US disclosed
EP-1216999-A1 Esters of the 3-(2-furyl)-2-propenoic acid with diols Basell Poliolefine Italia S.p.A. (IT) 2002-06-26 EP disclosed