SCHEMBL5906207

SCHEMBL5906207

COC(=O)C(C)=C(C)CCP(=O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FNTA P49354 1/20 0.34
FNTB P49356 1/20 0.34
ALDH1A1 P00352 1/20 0.33
ANPEP P15144 1/20 0.32
TYMS P04818 1/20 0.32
TSHR P16473 2/20 0.31
BTN3A1 O00481 1/20 0.31
LPAR3 Q9UBY5 3/20 0.30
LPAR2 Q9HBW0 1/20 0.30

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
SCHEMBL28846299 0.82 ACE (0.33) FNTAFNTBTYMS
SCHEMBL3890137 0.79 ENO1 (0.38) FNTAFNTBALDH1A1TSHR
SCHEMBL1137578 0.77 ACE (0.40) FNTAFNTBALDH1A1TYMSTSHR
Phosphoric Acid SCHEMBL28670149 0.75 ALDH1A1 (0.36) ALDH1A1
SCHEMBL29232987 0.74 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL5861522 0.74 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL27821923 0.74 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL135353 0.72 ALDH1A1 (0.37) ALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL6537990 0.72 ALDH1A1 (0.37) ALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL28895262 0.72 ALDH1A1 (0.37) ALDH1A1TSHR

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-20060251836-A1 Plastic moulded bodies, method for the production and use thereof KURARAY EUROPE GMBH (DE) 2006-11-09 US disclosed