SCHEMBL4030392

SCHEMBL4030392

NC(=O)[C@@H](CC(=O)O)NCCO

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.32
LMNA P02545 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32
TGFBR1 P36897 1/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ITGB3 P05106 3/20 0.31
ITGAV P06756 3/20 0.31
GGT1 P19440 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL5144359 1.00 GABRR1 (0.32) GABRR1LMNASLC22A6CA2CA4
SCHEMBL4553554 1.00 GABRR1 (0.32) GABRR1LMNASLC22A6CA2CA4
Aspartic Acid SCHEMBL7744939 0.89 GRIK1 (0.35) KMT2A
SCHEMBL8364636 0.89 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL1880686 0.88 CAMK2A (0.33) GABRR1LMNAALDH1A1ITGB3ITGAV
SCHEMBL8424379 0.88 CAMK2A (0.33) GABRR1LMNAALDH1A1ITGB3ITGAV
SCHEMBL28308288 0.86 GPR84 (0.34) TDP1
Phenol SCHEMBL29187478 0.85 ALDH1A1 (0.38) LMNACA2CA4ALDH1A1MAPT
SCHEMBL3441239 0.85 ECE1 (0.38) MEN1USP2ALDH1A1MAPTKMT2A
SCHEMBL1221420 0.85 ECE1 (0.38) MEN1USP2ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070166383-A1 Anionic hydrogel matrices with ph dependent modified release as drug carriers SIGMA-TAU INDUSTIRE FARMACEUTICHE RIUNITE S.P.A. (IT) 2007-07-19 US claimed
EP-1729732-A1 ANIONIC HYRDOGEL MATRICES WITH PH DEPENDENT MODIFIED RELEASE AS DRUG CARRIERS SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) 2006-12-13 EP claimed
WO-2005094792-A1 ANIONIC HYDROGEL MATRICES WITH PH DEPENDENT MODIFIED RELEASE AS DRUG CARRIERS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2005-10-13 WO claimed
EP-1729732-B1 ANIONIC HYDROGEL MATRICES WITH PH DEPENDENT MODIFIED RELEASE AS DRUG CARRIERS SIGMA TAU IND FARMACEUTI (IT) 2009-04-15 EP disclosed
US-20070166383-A1 Anionic hydrogel matrices with ph dependent modified release as drug carriers SIGMA-TAU INDUSTIRE FARMACEUTICHE RIUNITE S.P.A. (IT) 2007-07-19 US disclosed
EP-1729732-A1 ANIONIC HYRDOGEL MATRICES WITH PH DEPENDENT MODIFIED RELEASE AS DRUG CARRIERS SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) 2006-12-13 EP disclosed
WO-2005094792-A1 ANIONIC HYDROGEL MATRICES WITH PH DEPENDENT MODIFIED RELEASE AS DRUG CARRIERS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2005-10-13 WO disclosed