SCHEMBL7933735

SCHEMBL7933735

CC(C)(C)CC(C)(C)c1cc(C(=O)OCCO)ccc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 1/20 0.47
ESR1 P03372 4/20 0.46
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
MDH1 P40925 5/20 0.43
MDH2 P40926 5/20 0.43
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
HSD17B2 P37059 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL7933825 0.88 KDM4E (0.48) HDAC6ESR1KDM4EPOLBCA12
SCHEMBL7940256 0.86 HSP90AA1 (0.52) HDAC6ESR1KDM4EPOLBCA12
SCHEMBL7933737 0.85 ESR1 (0.51) HDAC6ESR1KDM4EPOLBCA12
SCHEMBL7943051 0.84 HDAC6 (0.48) HDAC6KDM4EPOLBMDH1MDH2
SCHEMBL7933567 0.81 SERPINE1 (0.42) ESR1KDM4ESMN1; SMN2LMNAMAPK1
SCHEMBL7944749 0.80 ESR1 (0.52) ESR1CA12CA1CA2CA7
SCHEMBL7933960 0.79 ESR1 (0.43) ESR1CA12CA1CA2CA7
SCHEMBL3810030 0.78 POLB (0.52) KDM4EPOLBCA12CA1CA2
SCHEMBL7933761 0.77 APP (0.52) MDH1MDH2SMN1; SMN2CYP1A2CYP2C19
SCHEMBL7941343 0.76 SCN1A (0.40) ESR1SMN1; SMN2LMNACYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed
EP-0861847-A2 Stabilizer composition and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-09-02 EP disclosed