SCHEMBL3928619

SCHEMBL3928619

CSCC[C@H](NC(C)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FNTA P49354 16/20 0.47
FNTB P49356 16/20 0.47
PGGT1B P53609 14/20 0.47
GNPAT O15228 1/20 0.46
SIRT5 Q9NXA8 1/20 0.44
FOLH1 Q04609 1/20 0.43

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
SCHEMBL31279889 1.00 FNTA (0.47) FNTAFNTBPGGT1BGNPATSIRT5
SCHEMBL30463272 0.94 FNTA (0.45) FNTAFNTBPGGT1BGNPATSIRT5
SCHEMBL30463248 0.92 FOLH1 (0.46) FNTAFNTBPGGT1BGNPATSIRT5
SCHEMBL30463274 0.92 FOLH1 (0.46) FNTAFNTBPGGT1BGNPATSIRT5
SCHEMBL30463266 0.92 GNPAT (0.53) FNTAFNTBPGGT1BGNPATSIRT5
SCHEMBL29428964 0.92 FOLH1 (0.46) FNTAFNTBPGGT1BGNPATSIRT5
SCHEMBL1718474 0.91 GNPAT (0.53) GNPATSIRT5FOLH1
SCHEMBL31094973 0.91 GNPAT (0.53) GNPATSIRT5FOLH1
SCHEMBL29655002 0.91 GNPAT (0.53) GNPATSIRT5FOLH1
SCHEMBL29454444 0.91 GNPAT (0.53) GNPATSIRT5FOLH1

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
WO-2009007307-A1 SELF-TANNING COMPOSITIONS WITH NATURAL TANNING EFFECT HENKEL AG & CO. KGAA (DE) 2009-01-15 WO disclosed