SCHEMBL7380176

SCHEMBL7380176

COc1cc[c]cc1OCC(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.45
GLA P06280 1/20 0.45
LMNA P02545 2/20 0.42
HDAC1 Q13547 2/20 0.41
HDAC2 Q92769 2/20 0.41
HDAC8 Q9BY41 2/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
HSD17B10 Q99714 2/20 0.41
HPGD P15428 1/20 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
SCHEMBL3209384 0.93 POLB (0.62) POLBSMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL6718467 0.90 L3MBTL1 (0.50) POLBSMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL5460045 0.85 L3MBTL1 (0.65) POLBSMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL9023825 0.85 LMNA (0.45) POLBSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL9024048 0.79 LMNA (0.45) POLBSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL5619089 0.78 KDM4E (0.44) POLBSMN1; SMN2KMT2AL3MBTL1GLA
SCHEMBL3931134 0.78 PKM (0.45) POLBSMN1; SMN2L3MBTL1GLAHPGD
SCHEMBL9449953 0.78 TDP1 (0.56) POLBSMN1; SMN2KMT2AL3MBTL1GLA
SCHEMBL5503687 0.78 PKM (0.53) POLBSMN1; SMN2L3MBTL1GLAHPGD
SCHEMBL9025222 0.78 LMNA (0.47) POLBSMN1; SMN2MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0398179-B1 Rhodanine derivatives and pharmaceutical compositions NISSHIN FLOUR MILLING CO (JP) 1996-01-17 EP disclosed
US-5389620-A Bronchodilation agent, vasodilation BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-02-14 US disclosed
US-5116855-A Aldose reductase inhibitors; antidiabetic agents NISSHIN FLOUR MILLING CO., LTD. (JP) 1992-05-26 US disclosed
EP-0398179-A1 Rhodanine derivatives and pharmaceutical compositions NISSHIN FLOUR MILLING CO., LTD. (JP) 1990-11-22 EP disclosed