SCHEMBL7786557

SCHEMBL7786557

CCc1cc(C(=O)O)cc(C2(C)CCCCC2)c1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.47
RARG P13631 6/20 0.47
RARA P10276 4/20 0.47
PTGDR Q13258 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
RXRA P19793 6/20 0.39
TPMT P51580 4/20 0.37
TP53 P04637 1/20 0.36
RXRB P28702 3/20 0.34
RXRG P48443 3/20 0.34
CYP26A1 O43174 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP26B1 Q9NR63 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA3 P07451 1/20 0.34
PKM P14618 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34

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
SCHEMBL7794974 0.83 RARB (0.49) RARBRARGRARAPTGDRPTGDR2
SCHEMBL7933836 0.83 SLC29A1 (0.38) RARBRARGRARAPTGDRPTGDR2
SCHEMBL7786437 0.82 RARB (0.48) RARBRARGRARAPTGDRPTGDR2
SCHEMBL7792167 0.82 PTGDR (0.43) RARBRARGRARAPTGDRPTGDR2
SCHEMBL8400776 0.80 ALOX5 (0.43) RARBRARGRARAPTGDRPTGDR2
SCHEMBL8400766 0.80 PTGDR (0.36) RARBRARGRARAPTGDRPTGDR2
SCHEMBL7796429 0.80 CYP26B1 (0.41) RARBRARGRARAPTGDRPTGDR2
SCHEMBL7942422 0.79 PTGDR (0.36) RARBRARGRARAPTGDRPTGDR2
SCHEMBL8400764 0.78 RARB (0.37) RARBRARGRARAPTGDRPTGDR2
SCHEMBL6568848 0.77 RARB (0.36) RARBRARGRARAPTGDRPTGDR2

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 4 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-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