SCHEMBL1446876

SCHEMBL1446876

CCCCOC(=O)N1CCC(OCCOC)(C(=O)O)CC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
POLB P06746 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
OPRD1 P41143 2/20 0.43
OPRK1 P41145 1/20 0.43
MMP2 P08253 4/20 0.40
MMP3 P08254 4/20 0.40
MMP9 P14780 4/20 0.40
MMP8 P22894 4/20 0.40
MMP13 P45452 4/20 0.40
HRH2 P25021 1/20 0.37
HRH1 P35367 1/20 0.37
P2RY12 Q9H244 9/20 0.35
APP P05067 1/20 0.34
ALDH1A1 P00352 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MMP1 P03956 2/20 0.34
MMP7 P09237 2/20 0.34

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
SCHEMBL30659245 0.79 SMN1; SMN2 (0.56) LMNAPOLBSMN1; SMN2OPRD1OPRK1
SCHEMBL346648 0.79 SMN1; SMN2 (0.56) LMNAPOLBSMN1; SMN2OPRD1OPRK1
SCHEMBL1446592 0.78 USP2 (0.43) POLBSMN1; SMN2OPRD1OPRK1
SCHEMBL9405372 0.75 POLB (0.73) LMNAPOLBSMN1; SMN2HRH2HRH1
SCHEMBL31386109 0.75 POLB (0.52) LMNAPOLBSMN1; SMN2OPRD1OPRK1
SCHEMBL30135752 0.74 POLB (0.55) LMNAPOLBSMN1; SMN2OPRD1OPRK1
SCHEMBL4725898 0.74 POLB (0.55) LMNAPOLBSMN1; SMN2OPRD1OPRK1
SCHEMBL27842859 0.74 POLB (0.58) LMNAPOLBSMN1; SMN2OPRD1OPRK1
SCHEMBL17144281 0.73 SMN1; SMN2 (0.50) LMNAPOLBSMN1; SMN2OPRD1OPRK1
SCHEMBL27826063 0.73 SMN1; SMN2 (0.65) LMNAPOLBSMN1; SMN2OPRD1OPRK1

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
EP-2297153-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE Lexicon Pharmaceuticals, Inc. (US) 2011-03-23 EP disclosed
WO-2009131940-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE LEXICON PHARMACEUTICALS, INC. (US) 2009-10-29 WO disclosed