SCHEMBL13906054

SCHEMBL13906054

N#CCOc1ccc(CNCC(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 2/20 0.48
▸ LTA4H P09960 1/20 0.45
▸ BCHE P06276 1/20 0.41
▸ SCN3A Q9NY46 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ KDM4C Q9H3R0 1/20 0.41
▸ GID4 Q8IVV7 1/20 0.41
▸ SPHK2 Q9NRA0 1/20 0.40
▸ SPHK1 Q9NYA1 1/20 0.40
▸ MMP2 P08253 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ LMNA P02545 1/20 0.40

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
SCHEMBL7400264 0.79 FFAR1 (0.50) FFAR1KDM4ELMNA
SCHEMBL5352838 0.79 LOXL2 (0.53) FFAR1MMP2
SCHEMBL8760838 0.77 BCHE (0.73) FFAR1BCHEGID4SPHK2SPHK1
SCHEMBL1807496 0.76 MEN1 (0.61) FFAR1ALDH1A1KDM4E
SCHEMBL26968221 0.73 CHEK1 (0.46) FFAR1
SCHEMBL7399916 0.72 ALDH1A1 (0.52) FFAR1ALDH1A1KDM4ELMNA
SCHEMBL30172106 0.72 PKM (0.56) ALDH1A1
SCHEMBL4984973 0.71 CA2 (0.48) FFAR1KDM4ELMNA
SCHEMBL9515149 0.71 POLB (0.53) FFAR1ALDH1A1KDM4E
SCHEMBL287925 0.71 CA2 (0.54) ALDH1A1

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-7507757-B2 Substituted heterocyclic derivatives useful as antidiabetic and antiobesity agents and method BRISTOL-MYERS SQUIBB COMPANY (US) 2009-03-24 — — US disclosed
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