SCHEMBL7942930

SCHEMBL7942930

COc1cc(C(=O)OCCO)cc(C(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
BRD4 O60885 1/20 0.40
LMNA P02545 1/20 0.40
ALOX15 P16050 1/20 0.40
APEX1 P27695 1/20 0.40
MAPK1 P28482 1/20 0.40
RECQL P46063 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KMT2A Q03164 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 3/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 2/20 0.38
PKM P14618 2/20 0.38
NPSR1 Q6W5P4 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SERPINE1 P05121 1/20 0.37

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
SCHEMBL7944807 0.82 CA12 (0.49) ALDH1A1TDP1SERPINE1
SCHEMBL4728312 0.81 CA1 (0.48) ALDH1A1LMNAALOX15APEX1MAPK1
SCHEMBL8433343 0.77 ALDH1A1 (0.41) ALDH1A1LMNAALOX15APEX1MAPK1
SCHEMBL11236182 0.77 SERPINE1 (0.53) ALDH1A1KMT2ASMN1; SMN2MEN1MAPT
SCHEMBL4729201 0.76 RXRA (0.47) ALDH1A1LMNAALOX15APEX1MAPK1
SCHEMBL1189363 0.76 MAPT (0.45) ALDH1A1LMNAALOX15APEX1MAPK1
SCHEMBL7944853 0.76 TNFRSF1A (0.45) ALDH1A1LMNAMAPK1KMT2ASMN1; SMN2
SCHEMBL18675963 0.75 HDAC6 (0.48) TDP1KMT2AMEN1PKMSERPINE1
SCHEMBL7944737 0.75 ALOX5 (0.41) ALDH1A1LMNATDP1KMT2AMAPT
SCHEMBL21074268 0.74 CA1 (0.48) ALDH1A1LMNAALOX15APEX1MAPK1

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
US-5891939-A POLYMER STABILIZERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-04-06 US disclosed