SCHEMBL7994955

SCHEMBL7994955

COC(=O)c1cccc(CC(N)O)c1

nearest known ligand 0.74

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 6/20 0.74
LOXL2 Q9Y4K0 2/20 0.67
CYP4F2 P78329 2/20 0.60
CYP4A11 Q02928 2/20 0.60
FOLH1 Q04609 1/20 0.56
HIF1A Q16665 1/20 0.51
MRGPRX4 Q96LA9 2/20 0.50
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HPGD P15428 1/20 0.47

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
SCHEMBL15609287 0.89 SLC7A5 (0.76) SLC7A5LOXL2CYP4F2CYP4A11FOLH1
SCHEMBL28281252 0.89 SLC7A5 (0.76) SLC7A5LOXL2CYP4F2CYP4A11FOLH1
SCHEMBL13589439 0.89 SLC7A5 (0.76) SLC7A5LOXL2CYP4F2CYP4A11FOLH1
Hydrochloric Acid SCHEMBL7735284 0.88 SLC7A5 (0.74) SLC7A5LOXL2CYP4F2CYP4A11FOLH1
SCHEMBL28124616 0.86 SLC7A5 (0.72) SLC7A5LOXL2CYP4F2CYP4A11FOLH1
SCHEMBL5111835 0.85 SLC7A5 (0.79) SLC7A5LOXL2CYP4F2CYP4A11FOLH1
SCHEMBL7261388 0.85 SLC7A5 (1.00) SLC7A5LOXL2CYP4F2CYP4A11FOLH1
SCHEMBL14032571 0.85 SLC7A5 (0.79) SLC7A5LOXL2CYP4F2CYP4A11FOLH1
SCHEMBL28870464 0.85 SLC7A5 (0.70) SLC7A5LOXL2CYP4F2CYP4A11FOLH1
SCHEMBL1790854 0.84 SLC7A5 (0.68) SLC7A5LOXL2CYP4F2CYP4A11FOLH1

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-2001085723-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS (II) JAMES BLACK FOUNDATION LIMITED (GB) 2001-11-15 WO disclosed