SCHEMBL6577591

SCHEMBL6577591

CCCc1ccccc1-c1cccc(C=O)c1C(=O)CC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.38
FOLH1 Q04609 2/20 0.35
PTGER1 P34995 1/20 0.35
PTGER4 P35408 1/20 0.35
PTGER3 P43115 1/20 0.35
PTGER2 P43116 1/20 0.35
PTPN1 P18031 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
PPARG P37231 1/20 0.34
ALDH1A1 P00352 2/20 0.33
CNR2 P34972 1/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL1666508 0.79 MEN1 (0.38) PPARAALDH1A1MEN1LMNATHRB
SCHEMBL2859889 0.78 CYP1A2 (0.35) PPARAFOLH1PPARGALDH1A1HTT
SCHEMBL28224452 0.77 BID (0.49) PPARAFOLH1PTPN1PPARG
SCHEMBL547665 0.74 LMNA (0.50) PTGDR2ALDH1A1MEN1LMNATHRB
SCHEMBL28206869 0.73 ERN1 (0.50) PTPN1ALDH1A1MEN1THRBKMT2A
Fluoride SCHEMBL14237094 0.72 LMNA (0.48) PTGDR2ALDH1A1MEN1LMNATHRB
SCHEMBL2179847 0.72 LIPG (0.42) PPARAALDH1A1MEN1LMNATHRB
SCHEMBL6704515 0.72 PPARA (0.41) PPARAALDH1A1HPGDCTSLCTSS
SCHEMBL29953931 0.72 ERN1 (0.52) MEN1LMNATHRBBLMKMT2A
SCHEMBL1527632 0.72 ERN1 (0.52) MEN1LMNATHRBBLMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1456160-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2004-09-15 EP disclosed
WO-2003050067-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, SNC (FR) 2003-06-19 WO disclosed