SCHEMBL6202636

SCHEMBL6202636

C=C/C=C/C/C=C/CCCCC/C=C/CC/C=C/C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
F7 P08709 5/20 0.38
F3 P13726 5/20 0.38
FABP3 P05413 5/20 0.38
KDM4E B2RXH2 4/20 0.38
CYP19A1 P11511 3/20 0.38
PPARG P37231 3/20 0.38
PPARD Q03181 3/20 0.38
PPARA Q07869 3/20 0.38
OXER1 Q8TDS5 2/20 0.38
MAPT P10636 2/20 0.38
FFAR1 O14842 2/20 0.38
LMNA P02545 2/20 0.38
CYP3A4 P08684 2/20 0.38
HPGD P15428 2/20 0.38
ALOX15 P16050 2/20 0.38
PTGS1 P23219 2/20 0.38
FFAR4 Q5NUL3 2/20 0.38
HSD17B10 Q99714 2/20 0.38
TDP1 Q9NUW8 2/20 0.38

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
SCHEMBL6202638 1.00 ALDH1A1 (0.38) ALDH1A1F7F3FABP3KDM4E
SCHEMBL6199757 0.92 PPARA (0.31) ALDH1A1CYP19A1PPARGPPARAOXER1
SCHEMBL4929453 0.92 PPARA (0.31) ALDH1A1CYP19A1PPARGPPARAOXER1
SCHEMBL6199761 0.92 PPARA (0.31) ALDH1A1CYP19A1PPARGPPARAOXER1
SCHEMBL4929461 0.92 PPARA (0.31) ALDH1A1CYP19A1PPARGPPARAOXER1
SCHEMBL16103148 0.89 ALOX12 (0.33) ALDH1A1F7F3KDM4ECYP19A1
SCHEMBL16103147 0.89 ALOX12 (0.33) ALDH1A1F7F3KDM4ECYP19A1
SCHEMBL27516649 0.88 ALDH1A1 (0.37) ALDH1A1F7F3FABP3KDM4E
SCHEMBL25182458 0.85 SOAT1 (0.38) ALDH1A1F7F3KDM4ECYP19A1
SCHEMBL25181792 0.85 SOAT1 (0.38) ALDH1A1F7F3KDM4ECYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1268457-A4 REWORKABLE COMPOSITION OF OXIRANE(S) OR THIIRANE(S)-CONTAINING RESIN AND CURING AGENT LOCTITE CORP (US) 2005-07-20 EP claimed
JP-2003529643-A 2003-10-07 JP claimed
EP-1268457-A1 REWORKABLE COMPOSITION OF OXIRANE(S) OR THIIRANE(S)-CONTAINING RESIN AND CURING AGENT LOCTITE CORPORATION (US) 2003-01-02 EP claimed
WO-2001074798-A1 REWORKABLE COMPOSITION OF OXIRANE(S) OR THIIRANE(S)-CONTAINING RESIN AND CURING AGENT LOCTITE CORPORATION (US) 2001-10-11 WO claimed
EP-1268457-A4 REWORKABLE COMPOSITION OF OXIRANE(S) OR THIIRANE(S)-CONTAINING RESIN AND CURING AGENT LOCTITE CORP (US) 2005-07-20 EP disclosed
EP-1268457-A1 REWORKABLE COMPOSITION OF OXIRANE(S) OR THIIRANE(S)-CONTAINING RESIN AND CURING AGENT LOCTITE CORPORATION (US) 2003-01-02 EP disclosed
WO-2001074798-A1 REWORKABLE COMPOSITION OF OXIRANE(S) OR THIIRANE(S)-CONTAINING RESIN AND CURING AGENT LOCTITE CORPORATION (US) 2001-10-11 WO disclosed