SCHEMBL1721731

SCHEMBL1721731

CCOC(=O)CCC1=CCN(C(=O)O)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.40
CYP4A11 Q02928 2/20 0.40
LMNA P02545 2/20 0.38
TSHR P16473 2/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 2/20 0.38
NOTUM Q6P988 1/20 0.38
GAA P10253 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
HRH3 Q9Y5N1 1/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
PTPN1 P18031 1/20 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
SCHEMBL1721055 0.83 ADORA1 (0.43) ALDH1A1L3MBTL1
SCHEMBL30924465 0.81 MEN1 (0.35) LMNATSHRALDH1A1L3MBTL1HRH3
SCHEMBL598302 0.78 ALDH1A1 (0.34) LMNAALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL10619024 0.77 MEN1 (0.51) CYP4F2CYP4A11LMNAALDH1A1L3MBTL1
SCHEMBL21840081 0.77 ALDH1A1 (0.36) LMNATSHRALDH1A1L3MBTL1HRH3
SCHEMBL23852946 0.77 MAPT (0.35) LMNATSHRALDH1A1GAASMN1; SMN2
SCHEMBL16836169 0.77 ALDH1A1 (0.36) ALDH1A1L3MBTL1
SCHEMBL23664480 0.73 ALDH1A1 (0.46) CYP4F2CYP4A11LMNATSHRALDH1A1
SCHEMBL8117386 0.73 MAPT (0.43) LMNATSHRPOLBALDH1A1GAA
SCHEMBL3988008 0.72 ALDH1A1 (0.51) CYP4F2CYP4A11LMNATSHRALDH1A1

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-2406251-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS Prosidion Limited (GB) 2012-01-18 EP disclosed
WO-2010103334-A1 COMPOUNDS FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2010-09-16 WO disclosed