SCHEMBL2807990

SCHEMBL2807990

CCCCCC(CC)c1cc(C)ccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.47
PLK1 P53350 14/20 0.44
PLK3 Q9H4B4 2/20 0.43
PPARA Q07869 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RARB P10826 1/20 0.40
TRPM2 O94759 1/20 0.40
CSNK2A1 P68400 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
SCHEMBL1401949 0.90 PLK1 (0.46) PDE5APLK1PLK3PPARAALDH1A1
SCHEMBL8364755 0.86 ACE2 (0.44) PPARARARB
SCHEMBL128528 0.86 HTT (0.46) PPARAALDH1A1RARB
SCHEMBL30522481 0.84 POLB (0.45) PPARAALDH1A1RARB
SCHEMBL5180293 0.84 PPARA (0.46) PPARAALDH1A1RARB
SCHEMBL4318400 0.84 ALDH1A1 (0.41) PPARAALDH1A1RARB
SCHEMBL45363 0.82 ALDH1A1 (0.39) PPARAALDH1A1RARB
SCHEMBL30402117 0.81 ALDH1A1 (0.40) PPARAALDH1A1RARB
SCHEMBL14352829 0.81 ALDH1A1 (0.41) PDE5APLK1PPARAALDH1A1RARB
SCHEMBL433915 0.81 ALDH1A1 (0.52) PLK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100068439-A1 POLYESTER COMPOSITION WITH IMPROVED GAS BARRIER PROPERTIES AND ARTICLES THEREOF INVISTA North aAmerica S.ar.I (US) 2010-03-18 US claimed
WO-2008095071-A1 POLYESTER COMPOSITION WITH IMPROVED GAS BARRIER PROPERTIES AND ARTICLES THEREOF INVISTA TECHNOLOGIES S.AR.L. (CH) 2008-08-07 WO claimed
EP-3260920-A1 TONER COMPOSITIONS WITH ANTIPLASTICIZERS Xerox Corporation (US) 2017-12-27 EP disclosed
US-9684257-B1 Toner compositions with antiplasticizers XEROX CORPORATION (US) 2017-06-20 US disclosed
US-20100068439-A1 POLYESTER COMPOSITION WITH IMPROVED GAS BARRIER PROPERTIES AND ARTICLES THEREOF INVISTA North aAmerica S.ar.I (US) 2010-03-18 US disclosed
WO-2008095071-A1 POLYESTER COMPOSITION WITH IMPROVED GAS BARRIER PROPERTIES AND ARTICLES THEREOF INVISTA TECHNOLOGIES S.AR.L. (CH) 2008-08-07 WO disclosed
EP-0510318-B1 Compositions for the topical treatment of burns NUCERA ANTONIO CARMELO (IT) 1995-12-13 EP disclosed
EP-0510318-A1 Compositions for the topical treatment of burns Nucera, Antonio Carmelo (IT) 1992-10-28 EP disclosed