SCHEMBL6859366

SCHEMBL6859366

NCCCCC(NCCCN)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.54
GGT1 P19440 2/20 0.53
GSR P00390 1/20 0.50
RNPEP Q9H4A4 1/20 0.48
MMP2 P08253 1/20 0.44
MMP9 P14780 1/20 0.44
CPB2 Q96IY4 6/20 0.44
SLC6A5 Q9Y345 1/20 0.42
TLR2 O60603 1/20 0.42
NOD1 Q9Y239 1/20 0.41
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
SIRT6 Q8N6T7 1/20 0.40
SIRT1 Q96EB6 1/20 0.40

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
SCHEMBL6316197 1.00 FOLH1 (0.54) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL7076576 0.96 FOLH1 (0.54) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL148480 0.96 FOLH1 (0.54) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL31040404 0.94 FOLH1 (0.53) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL28397660 0.94 FOLH1 (0.53) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL6890284 0.94 GGT1 (0.55) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL146727 0.94 GGT1 (0.55) FOLH1GGT1GSRRNPEPMMP2
Hydrochloric Acid SCHEMBL25352316 0.92 FOLH1 (0.51) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL610133 0.92 GGT1 (0.62) FOLH1GGT1GSRRNPEPMMP2
SCHEMBL610134 0.92 GGT1 (0.62) FOLH1GGT1GSRRNPEPMMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111107878-A Methods of treatment using amphetamine prodrugs 夏尔制药公司 2020-05-05 CN disclosed
US-6719958-B1 DIAGNOSTIC IMAGING; CONTRAST AGENTS FOR TISSUES OR ORGANS DIBRA S.P.A. (IT) 2004-04-13 US disclosed
EP-1151997-A1 Polychelants, their complexes with metal ions, their preparation and their uses BRACCO S.p.A. (IT) 2001-11-07 EP disclosed
EP-0885202-A1 POLYCHELANTS, THEIR COMPLEXES WITH METAL IONS, THEIR PREPARATION AND THEIR USES BRACCO S.p.A. (IT) 1998-12-23 EP disclosed
WO-1997032862-A1 POLYCHELANTS, THEIR COMPLEXES WITH METAL IONS, THEIR PREPARATION AND THEIR USES BRACCO S.P.A. (IT) 1997-09-12 WO disclosed