SCHEMBL5320263

SCHEMBL5320263

O=C(O)N1CCN(C2CN(Cc3ccccc3)CC2O)CC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC18A3 Q16572 8/20 0.56
FUCA1 P04066 2/20 0.55
GBA1 P04062 1/20 0.48
FAAH O00519 1/20 0.47
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
S1PR1 P21453 1/20 0.46
S1PR5 Q9H228 1/20 0.46

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
SCHEMBL13229742 0.90 SLC18A3 (0.54) SLC18A3FUCA1GBA1FAAH
SCHEMBL2796545 0.90 SLC18A3 (0.54) SLC18A3FUCA1GBA1FAAH
SCHEMBL3910954 0.88 SLC18A3 (0.56) SLC18A3FAAH
SCHEMBL13229592 0.88 KDM4E (0.61) SLC18A3FUCA1ALDH1A1LMNAKMT2A
SCHEMBL2792331 0.88 KDM4E (0.61) SLC18A3FUCA1ALDH1A1LMNAKMT2A
SCHEMBL2792852 0.87 FUCA1 (0.63) SLC18A3FUCA1GBA1ALDH1A1
SCHEMBL13229582 0.87 FUCA1 (0.63) SLC18A3FUCA1GBA1ALDH1A1
SCHEMBL14385505 0.85 SLC18A3 (0.55) SLC18A3FUCA1GBA1ALDH1A1S1PR1
SCHEMBL2847210 0.85 L3MBTL1 (0.51) SLC18A3FUCA1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL13229594 0.85 L3MBTL1 (0.51) SLC18A3FUCA1ALDH1A1KMT2ASMN1; SMN2

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-1849781-A1 Substituted 3-Amino-4-hydroxy pyrrolidines compounds, their preparation and use as medicaments Laboratorios del Dr. Esteve S.A. (ES) 2007-10-31 EP disclosed