SCHEMBL9253930

SCHEMBL9253930

[NH]C(=O)[CH]N1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
GAA P10253 2/20 0.32
HPGD P15428 3/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP9 P14780 1/20 0.32
CA2 P00918 1/20 0.31
CHKA P35790 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
F2 P00734 1/20 0.31
HSD17B10 Q99714 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL9259137 0.97
SCHEMBL11101489 0.74 ALDH1A1 (0.39) ALDH1A1GAAHPGDMMP1MMP2
SCHEMBL17710771 0.72 ALDH1A1 (0.38) ALDH1A1GAAHPGDMMP1MMP2
SCHEMBL6039604 0.72 L3MBTL1 (0.39) ALDH1A1GAAHPGDMMP1MMP2
SCHEMBL22684280 0.71
SCHEMBL17731151 0.70 ALDH1A1 (0.48) ALDH1A1HPGDMMP1MMP2MMP3
SCHEMBL6039343 0.69
SCHEMBL863592 0.69
SCHEMBL16935754 0.67 L3MBTL1 (0.35) ALDH1A1GAAPOLBMAPTHSD17B10
SCHEMBL11393780 0.67 HPGD (0.32) ALDH1A1HPGDHSD17B10

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
EP-0434943-B1 Polyene macrolide derivatives PRODOTTI ANTIBIOTICI SPA (IT) 1995-09-06 EP claimed