SCHEMBL7933932

SCHEMBL7933932

COc1ccc(C(CCO)C(=O)O)cc1C1(C)CCCCC1

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
PTGDR Q13258 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.45
AKR1C3 P42330 3/20 0.36
AKR1C2 P52895 3/20 0.36
LMNA P02545 1/20 0.36
AKR1C1 Q04828 1/20 0.36
PTGS1 P23219 1/20 0.36
SELL P14151 1/20 0.35
SELP P16109 1/20 0.35
ACHE P22303 1/20 0.34
TNF P01375 1/20 0.34
LDHA P00338 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PPARA Q07869 1/20 0.34
ITGB1 P05556 1/20 0.33

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
SCHEMBL7933778 0.85 RARB (0.45) RARARARBRARGPTGDRPTGDR2
SCHEMBL8397573 0.82 RARA (0.54) RARARARBRARGPTGDRPTGDR2
SCHEMBL7933907 0.81 RARB (0.34) RARARARBRARGPTGDRPTGDR2
SCHEMBL7942419 0.80 PTGDR (0.34) RARARARBRARGPTGDRPTGDR2
SCHEMBL7940459 0.78 RARA (0.33) RARARARBRARGPTGDRPTGDR2
SCHEMBL8594628 0.76 GLA (0.41) RARARARBRARGPTGDRPTGDR2
SCHEMBL18499352 0.76 GAA (0.48) AKR1C3AKR1C2AKR1C1PTGS1ACHE
SCHEMBL8397564 0.76 RARA (0.49) RARARARBRARGPTGDRPTGDR2
SCHEMBL8595049 0.75 GLA (0.43) RARARARBRARGPTGDRPTGDR2
SCHEMBL8399065 0.75 RARA (0.46) RARARARBRARGPTGDRPTGDR2

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 1 patent. 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