SCHEMBL6280253

SCHEMBL6280253

O=C(O)CCCCC(O)C=Cc1ccccc1OCCCCCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
CYSLTR2 Q9NS75 1/20 0.52
CYSLTR1 Q9Y271 1/20 0.52
PTGER4 P35408 2/20 0.48
LTB4R Q15722 2/20 0.47
FFAR1 O14842 1/20 0.47
S1PR5 Q9H228 2/20 0.46
S1PR1 P21453 7/20 0.46
S1PR3 Q99500 3/20 0.46
HDAC3 O15379 1/20 0.44
MAPK1 P28482 1/20 0.44
ADRA1A P35348 1/20 0.44
HDAC4 P56524 1/20 0.44
SLC6A3 Q01959 1/20 0.44
HDAC1 Q13547 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44

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
SCHEMBL6280250 1.00 MAPT (0.52) MAPTRXFP1CYSLTR2CYSLTR1PTGER4
SCHEMBL6001910 0.89 PPARG (0.53) CYSLTR2CYSLTR1S1PR1S1PR3TRPA1
SCHEMBL4510771 0.81 FFAR1 (0.43) MAPTRXFP1CYSLTR2CYSLTR1LTB4R
SCHEMBL4510764 0.81 FFAR1 (0.43) MAPTRXFP1CYSLTR2CYSLTR1LTB4R
SCHEMBL9518443 0.81 PPARG (0.55) CYSLTR2CYSLTR1LTB4R2
SCHEMBL9518451 0.81 PPARG (0.55) CYSLTR2CYSLTR1LTB4R2
SCHEMBL7013170 0.81 FFAR1 (0.45) MAPTRXFP1CYSLTR2CYSLTR1LTB4R
SCHEMBL9521115 0.77 PPARG (0.53) MAPTCYSLTR2CYSLTR1LTB4R2
SCHEMBL9469166 0.77 PPARG (0.53) MAPTCYSLTR2CYSLTR1LTB4R2
SCHEMBL9469170 0.77 PPARG (0.53) MAPTCYSLTR2CYSLTR1LTB4R2

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-6864287-B1 Derivatives of dicarboxylic acid having pharmaceutical properties BAYER AKTIENGESELLSCHAFT (DE) 2005-03-08 US disclosed