SCHEMBL11143392

SCHEMBL11143392

O=C(O)CC[C@H](NN1CCCC1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 5/20 0.50
NAALAD2 Q9Y3Q0 4/20 0.50
RIMKLA Q8IXN7 1/20 0.50
GGH Q92820 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CYP1A2 P05177 1/20 0.41
GAA P10253 1/20 0.40
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP13 P45452 1/20 0.39

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
SCHEMBL8934928 0.84 FOLH1 (0.46) FOLH1NAALAD2RIMKLAGGHSMN1; SMN2
SCHEMBL28307549 0.84 L3MBTL1 (0.42) FOLH1NAALAD2RIMKLAMMP9
SCHEMBL8934926 0.84 FOLH1 (0.46) FOLH1NAALAD2RIMKLAGGHSMN1; SMN2
SCHEMBL34475333 0.83 FOLH1 (0.44) FOLH1NAALAD2RIMKLAGGHSMN1; SMN2
SCHEMBL28212550 0.81 MME (0.40) SMN1; SMN2TDP1GAA
SCHEMBL28432618 0.79 MME (0.41) SMN1; SMN2TDP1CYP1A2GAA
SCHEMBL364062 0.76 CPB2 (0.50) FOLH1MMP9
SCHEMBL1604394 0.74 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGAA
SCHEMBL28381301 0.73 ALDH1A1 (0.49) FOLH1GAAMMP8
SCHEMBL30645305 0.73 ITGB2 (0.39)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4389342-A ARGININE, VALINE PERIGNON INVESTMENTS, LTD. (KY) 1983-06-21 US disclosed
US-4382920-A HYPOTHERMIC AGENTS, DECREASED OXYGEN CONSUMPTION PERIGNON INVESTMENTS LTD. (KY) 1983-05-10 US disclosed