SCHEMBL2556136

SCHEMBL2556136

O=CCOc1ccccc1OCC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 8/20 0.64
L3MBTL1 Q9Y468 2/20 0.62
POLB P06746 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
GLA P06280 1/20 0.62
KDM4E B2RXH2 2/20 0.54
ALDH1A1 P00352 2/20 0.54
HPGD P15428 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALOX15 P16050 1/20 0.52
HSD17B10 Q99714 2/20 0.44
CASP1 P29466 1/20 0.44
CTSL P07711 1/20 0.44
CTSS P25774 1/20 0.44
CTSK P43235 1/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL340762 0.86 L3MBTL1 (0.80) PTGDR2L3MBTL1POLBSMN1; SMN2GLA
SCHEMBL29682135 0.86 L3MBTL1 (0.80) PTGDR2L3MBTL1POLBSMN1; SMN2GLA
Succinic Acid SCHEMBL6888240 0.84 L3MBTL1 (0.71) PTGDR2L3MBTL1POLBSMN1; SMN2GLA
Ammonia Solution, Strong SCHEMBL28240461 0.84 L3MBTL1 (0.77) PTGDR2L3MBTL1POLBSMN1; SMN2GLA
SCHEMBL22323844 0.84 L3MBTL1 (0.61) PTGDR2L3MBTL1POLBSMN1; SMN2GLA
SCHEMBL27777100 0.81 PTGDR2 (0.64) PTGDR2L3MBTL1POLBSMN1; SMN2GLA
SCHEMBL7082489 0.81 LMNA (0.54) PTGDR2ALDH1A1
SCHEMBL8115884 0.80 L3MBTL1 (0.71) PTGDR2L3MBTL1POLBSMN1; SMN2GLA
SCHEMBL21250152 0.79 L3MBTL1 (0.69) PTGDR2L3MBTL1POLBSMN1; SMN2GLA
SCHEMBL1123330 0.79 L3MBTL1 (0.63) PTGDR2L3MBTL1POLBSMN1; SMN2GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4654435-A WITH ORGANIC COMPOUNDS HAVING BOTH A CARBOXYL GROUP AND AN ALDEHYDE GROUP NIPPON ZEON CO., LTD. (JP) 1987-03-31 US claimed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed
US-4654435-A WITH ORGANIC COMPOUNDS HAVING BOTH A CARBOXYL GROUP AND AN ALDEHYDE GROUP NIPPON ZEON CO., LTD. (JP) 1987-03-31 US disclosed
EP-0087109-B1 MODIFIED RUBBER COMPOSITION NIPPON ZEON CO., LTD. (JP) 1986-10-29 EP disclosed
EP-0087110-B1 PROCESS FOR MODIFYING RUBBERS NIPPON ZEON CO., LTD. (JP) 1986-10-29 EP disclosed
US-4412031-A CARBON BLACK NIPPON ZEON CO., LTD. (JP) 1983-10-25 US disclosed
US-4412041-A IN PRESENCE OF ACID CATALYSTS NIPPON ZEON CO. LTD. (JP) 1983-10-25 US disclosed
EP-0087109-A1 Modified rubber composition NIPPON ZEON CO., LTD. (JP) 1983-08-31 EP disclosed
EP-0087110-A1 Process for modifying rubbers NIPPON ZEON CO., LTD. (JP) 1983-08-31 EP disclosed