SCHEMBL7794784

SCHEMBL7794784

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.52
RXRB P28702 3/20 0.52
RXRG P48443 2/20 0.52
PTGS1 P23219 1/20 0.49
AKR1C3 P42330 1/20 0.49
AKR1C2 P52895 1/20 0.49
NR1H4 Q96RI1 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ELANE P08246 1/20 0.43
CD69 Q07108 1/20 0.43
KDM4E B2RXH2 2/20 0.42
POLB P06746 2/20 0.42
RECQL P46063 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
ABL1 P00519 1/20 0.42
MAPT P10636 1/20 0.42
RIN1 Q13671 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
GAA P10253 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
SCHEMBL4670746 0.85 RXRA (0.70) RXRARXRBRXRGPTGS1AKR1C3
SCHEMBL7794809 0.84 RXRA (0.54) RXRARXRBRXRGNR1H4ELANE
SCHEMBL10717865 0.84 RXRA (0.68) RXRARXRBRXRGNR1H4SMN1; SMN2
SCHEMBL347352 0.84 PTGS1 (0.59) RXRARXRBRXRGPTGS1AKR1C3
Hydrochloric Acid SCHEMBL2531690 0.82 PTGS1 (0.58) RXRARXRBRXRGPTGS1AKR1C3
SCHEMBL5315605 0.81 CALM1 (0.54) RXRARXRBRXRGPTGS1AKR1C3
SCHEMBL1790738 0.81 MAPT (0.40) RXRARXRBRXRGAKR1C3AKR1C2
SCHEMBL8433343 0.79 ALDH1A1 (0.41) RXRARXRBRXRGNR1H4SMN1; SMN2
SCHEMBL20285804 0.79 CA1 (0.42) NR1H4RECQLMAPTHSD17B10ALDH1A1
SCHEMBL1790737 0.79 MAPT (0.41) RXRARXRBRXRGAKR1C3AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0823435-B1 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL CO (JP) 2001-11-21 EP disclosed
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-5889095-A OXYGEN AND HEAT RESISTANCE SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1999-03-30 US disclosed
EP-0823435-A2 Phosphites, process for producing the same and their use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-02-11 EP disclosed