SCHEMBL22729318

SCHEMBL22729318

COC(=O)CCC(=O)N1C(=O)CCC1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
NOTUM Q6P988 1/20 0.45
LMNA P02545 3/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HTT P42858 2/20 0.41
HSD17B10 Q99714 1/20 0.41
KDM4E B2RXH2 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
BRD4 O60885 1/20 0.38
GLA P06280 1/20 0.38
KAT2B Q92831 2/20 0.36
MEN1 O00255 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
CA12 O43570 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
SCHEMBL10889100 0.78 SMN1; SMN2 (0.42) LMNAMAPTKMT2AALDH1A1HTT
SCHEMBL2454952 0.77 TSHR (0.50) TSHRNOTUMLMNAMAPTKMT2A
SCHEMBL14275065 0.76 HPGD (0.43) TSHRLMNAMAPTKMT2AALDH1A1
SCHEMBL8178094 0.75 CES1 (0.43) TSHRLMNAKMT2ASMN1; SMN2
SCHEMBL29366012 0.74 LMNA (0.40) LMNAMAPTKMT2AALDH1A1HTT
SCHEMBL5590841 0.74 SMN1; SMN2 (0.49) TSHRALDH1A1HTTHSD17B10KDM4E
SCHEMBL9634740 0.74 LMNA (0.41) TSHRLMNAL3MBTL1CA12CA14
SCHEMBL19432778 0.74 CYP2D6 (0.35) TSHRLMNAMAPTKMT2AALDH1A1
SCHEMBL24721083 0.73 GAA (0.33) HTTSMN1; SMN2GAAHPGD
SCHEMBL16203504 0.73 LMNA (0.39) LMNA

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-3746151-A1 EXTRACORPOREAL DEVICE AND MATRIX FOR REMOVING FIBRINOLYTIC PROTEINS FROM BIOLOGICAL FLUIDS, METHODS AND USES THEREOF PLAS-FREE LTD. (IL) 2020-12-09 EP disclosed