SCHEMBL328706

SCHEMBL328706

CCCCc1cc(C(C)C(=O)OC)cc(CCCC)c1O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.41
PTGS2 P35354 4/20 0.40
EGFR P00533 1/20 0.40
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
MT-CO2 P00403 1/20 0.39
PTGS1 P23219 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
TYR P14679 1/20 0.36
ESR1 P03372 2/20 0.36
MAOA P21397 1/20 0.35
ZDHHC7 Q9NXF8 1/20 0.35

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
SCHEMBL10272267 1.00 ALOX5 (0.41) ALOX5PTGS2EGFRPSEN1PSEN2
SCHEMBL872574 0.88 EGFR (0.40) ALOX5PTGS2EGFRPSEN1PSEN2
SCHEMBL29175219 0.87 EGFR (0.42) ALOX5PTGS2EGFRTYRESR1
SCHEMBL13180438 0.87 TDP1 (0.40) ALOX5PTGS2EGFRTYRESR1
SCHEMBL28006185 0.84 ESR1 (0.47) ALOX5PTGS2ESR1
SCHEMBL1629294 0.83 EGFR (0.41) ALOX5PTGS2EGFRTYRMAOA
SCHEMBL10272893 0.83 EGFR (0.37) ALOX5PTGS2EGFRTYRESR1
SCHEMBL328666 0.83 EGFR (0.37) ALOX5PTGS2EGFRTYRESR1
SCHEMBL328642 0.83 EGFR (0.37) ALOX5PTGS2EGFRTYRESR1
SCHEMBL872522 0.83 EGFR (0.43) ALOX5PTGS2EGFRTYRMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8299006-B2 Compressor oil composition NIPPON OIL CORPORATION (JP) 2012-10-30 US disclosed
US-8236740-B2 Lubricating oil composition NIPPON OIL CORPORATION (JP) 2012-08-07 US disclosed
EP-2428555-A1 Metalworking oil composition Nippon Oil Corporation (JP) 2012-03-14 EP disclosed
EP-2428554-A1 Heat treating oil composition Nippon Oil Corporation (JP) 2012-03-14 EP disclosed
EP-2428553-A1 Lubricating oil composition Nippon Oil Corporation (JP) 2012-03-14 EP disclosed
US-20120053102-A1 Lubricating oil composition NIPPON OIL CORPORATION 2012-03-01 US disclosed
EP-2423297-A1 Hydraulic oil composition Nippon Oil Corporation (JP) 2012-02-29 EP disclosed
EP-2423296-A1 Lubricating oil composition for machine tools Nippon Oil Corporation (JP) 2012-02-29 EP disclosed
US-20120046205-A1 Compressor oil composition NIPPON OIL CORPORATION 2012-02-23 US disclosed
EP-2006365-A9 POLYFUNCTIONAL HYDROCARBON OIL COMPOSITION Nippon Oil Corporation (JP) 2009-07-29 EP disclosed
EP-2039746-A1 REFRIGERATOR OIL, COMPRESSOR OIL COMPOSITION, HYDRAULIC FLUID COMPOSITION, METALWORKING FLUID COMPOSITION, HEAT TREATMENT OIL COMPOSITION, LUBRICANT COMPOSITION FOR MACHINE TOOL AND LUBRICANT COMPOSITION Nippon Oil Corporation (JP) 2009-03-25 EP disclosed
EP-2006365-A2 POLYFUNCTIONAL HYDROCARBON OIL COMPOSITION Nippon Oil Corporation (JP) 2008-12-24 EP disclosed