SCHEMBL8463263

SCHEMBL8463263

C=CCCOc1cc(C(=O)OCC)ccc1C(=O)OCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 1/20 0.48
CA12 O43570 3/20 0.46
CA1 P00915 3/20 0.46
CA2 P00918 3/20 0.46
CA7 P43166 3/20 0.46
CA9 Q16790 3/20 0.46
CA14 Q9ULX7 3/20 0.46
KDM4E B2RXH2 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 2/20 0.43
TP53 P04637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
CYP1A2 P05177 2/20 0.41
TSHR P16473 2/20 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
SCHEMBL8774940 0.86 KDM4E (0.47) CA12CA1CA2CA7CA9
SCHEMBL15528629 0.82 KDM4E (0.65) KDM4EL3MBTL1ALDH1A1MEN1KMT2A
SCHEMBL28904619 0.82 HSD17B2 (0.51) HSD17B2CA12CA1CA2CA7
SCHEMBL9379667 0.82 ALDH1A1 (0.59) CA12CA1CA2CA7CA9
SCHEMBL25248481 0.81 HSD17B2 (0.50) HSD17B2CA12CA1CA2CA7
SCHEMBL27493026 0.81 TSHR (0.51) HSD17B2ALDH1A1LMNATP53ESR1
SCHEMBL25287265 0.81 HSD17B2 (0.50) HSD17B2CA12CA1CA2CA7
SCHEMBL8461962 0.81 KDM4E (0.43) KDM4EL3MBTL1TDP1ALDH1A1CYP1A2
SCHEMBL28750216 0.80 HSD17B2 (0.49) HSD17B2CA12CA1CA2CA7
SCHEMBL12787213 0.79 L3MBTL1 (0.46) HSD17B2CA12CA1CA2CA7

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
EP-0641832-B1 Diorganopolysiloxane-Rigid aromatic polymer compositions and preparation thereof DOW CORNING ASIA LTD (JP) 1999-01-13 EP disclosed
EP-0641831-B1 Organopolysiloxane-grafted polybenzobisoxazoles and method for preparing same DOW CORNING ASIA LTD (JP) 1997-11-12 EP disclosed
US-5527862-A COMPATIBLE BLENDS; REINFORCED CURED COMPOSITES; HIGH STRENGTH DOW CORNING ASIA, LTD. (JP) 1996-06-18 US disclosed
US-5464922-A Organopolysiloxane-grafted polybenzobisoxazoles and method for preparing same DOW CORNING ASIA LTD. (JP) 1995-11-07 US disclosed
EP-0641832-A1 Diorganopolysiloxane-Rigid aromatic polymer compositions and preparation thereof DOW CORNING ASIA, Ltd. (JP) 1995-03-08 EP disclosed
EP-0641831-A1 Organopolysiloxane-grafted polybenzobisoxazoles and method for preparing same DOW CORNING ASIA, Ltd. (JP) 1995-03-08 EP disclosed