SCHEMBL7940070

SCHEMBL7940070

COc1ccc(C(=O)OCCO)cc1C(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARA P10276 2/20 0.49
RARB P10826 2/20 0.49
RARG P13631 2/20 0.49
KDM4E B2RXH2 2/20 0.49
POLB P06746 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
MAPT P10636 3/20 0.48
TSHR P16473 2/20 0.48
HSD17B2 P37059 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 5/20 0.43
WDR5 P61964 1/20 0.43
BRD4 O60885 1/20 0.42
MEN1 O00255 3/20 0.41
GAA P10253 2/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.40
PKM P14618 1/20 0.40
THRA P10827 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
SCHEMBL7941193 0.88 KDM4E (0.49) RARARARBRARGKDM4EPOLB
SCHEMBL7943051 0.87 HDAC6 (0.48) RARARARBRARGKDM4EPOLB
SCHEMBL7940314 0.86 THRA (0.46) RARARARBRARGKDM4EPOLB
SCHEMBL21376220 0.85 HSD17B2 (0.61) RARARARBRARGKDM4EPOLB
SCHEMBL8874249 0.84 MAPT (0.48) RARARARBRARGKDM4EPOLB
SCHEMBL7943054 0.82 CNR2 (0.48) KDM4EPOLBHDAC6MAPTTSHR
SCHEMBL7940256 0.82 HSP90AA1 (0.52) RARARARBRARGKDM4EPOLB
SCHEMBL5027170 0.82 MAPT (0.58) RARARARBRARGKDM4EMAPT
SCHEMBL8839085 0.81 RARA (0.48) RARARARBRARGKDM4EMAPT
SCHEMBL7944853 0.81 TNFRSF1A (0.45) KDM4ETSHRMAPK1KMT2AMEN1

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