SCHEMBL11269425

SCHEMBL11269425

NCCCCCc1ccc(CCC(=O)O)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.58
RXFP1 Q9HBX9 1/20 0.58
FFAR1 O14842 6/20 0.57
MAOA P21397 1/20 0.55
KEAP1 Q14145 1/20 0.55
SLC6A3 Q01959 2/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
PLG P00747 1/20 0.54
LMNA P02545 1/20 0.54
THRB P10828 1/20 0.54
ALOX15 P16050 1/20 0.54
SLC6A2 P23975 1/20 0.54
RECQL P46063 1/20 0.54
KMT2A Q03164 1/20 0.54
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
HDAC3 O15379 1/20 0.52
MAPK1 P28482 1/20 0.52
ADRA1A P35348 1/20 0.52

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
SCHEMBL11134916 1.00 MAPT (0.58) MAPTRXFP1FFAR1MAOAKEAP1
SCHEMBL25941287 0.93 FFAR1 (0.65) MAPTRXFP1FFAR1MAOAKEAP1
SCHEMBL11135780 0.92 MAPT (0.63) MAPTRXFP1FFAR1MAOASLC6A3
SCHEMBL11032273 0.92 FFAR1 (0.61) MAPTRXFP1FFAR1KEAP1SLC6A3
SCHEMBL7827706 0.90 MAPT (0.69) MAPTRXFP1FFAR1KEAP1SLC6A3
SCHEMBL11131939 0.85 HRH1 (0.50) MAPTRXFP1MAOAALDH1A1LMNA
SCHEMBL11137338 0.85 ALDH1A1 (0.65) MAPTRXFP1MAOASLC6A3MEN1
SCHEMBL11134216 0.84 HDAC3 (0.54) MAPTRXFP1FFAR1KEAP1SLC6A3
SCHEMBL11134102 0.84 HDAC3 (0.54) MAPTRXFP1FFAR1KEAP1SLC6A3
SCHEMBL11133284 0.84 HDAC3 (0.54) MAPTRXFP1FFAR1KEAP1SLC6A3

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-0044541-A1 Aminocarboxylic acids, amino alcohols, or the derivatives thereof, processes for production thereof, and pharmaceutical composition, containing at least one of these compounds TEIJIN LIMITED (JP) 1982-01-27 EP disclosed