SCHEMBL8735219

SCHEMBL8735219

C=C(C)C(=O)OC(C)NC(=O)Nc1ccccc1Cc1ccccc1NC(=O)Nc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
HTT P42858 2/20 0.43
KMT2A Q03164 6/20 0.42
MEN1 O00255 5/20 0.42
GPR174 Q9BXC1 1/20 0.42
HSD17B10 Q99714 1/20 0.41
MAPT P10636 2/20 0.40
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
LMNA P02545 1/20 0.39
EPHX2 P34913 2/20 0.39
TAAR1 Q96RJ0 1/20 0.39
CCR3 P51677 1/20 0.38
HIF1A Q16665 1/20 0.38
TP53 P04637 1/20 0.38
EPHX1 P07099 1/20 0.38

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
SCHEMBL12310351 0.87 HSD17B10 (0.53) KMT2AMEN1GPR174HSD17B10MAPT
SCHEMBL8735211 0.81 HSD17B10 (0.45) KMT2AMEN1HSD17B10EPHX2
SCHEMBL17284155 0.76 MEN1 (0.45) L3MBTL1ALDH1A1POLBKMT2AMEN1
SCHEMBL28804381 0.74 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1HSD17B10MAPT
SCHEMBL305727 0.71 ALDH1A1 (0.45) L3MBTL1ALDH1A1HTTKMT2AMEN1
SCHEMBL11028218 0.70 HTT (0.77) ALDH1A1POLBHTTKMT2AMEN1
SCHEMBL26082853 0.69 MEN1 (0.62) ALDH1A1POLBHTTKMT2AMEN1
SCHEMBL8203974 0.69 LMNA (0.53) L3MBTL1ALDH1A1HTTKMT2AMEN1
SCHEMBL21073953 0.68 NAALAD2 (0.53) L3MBTL1ALDH1A1KMT2ANPC1RAB9A
SCHEMBL28964245 0.68 TSHR (0.46) ALDH1A1HTTKMT2AMEN1MAPT

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
EP-0714417-B1 POLYMER SURFACE COATINGS BIOCOMPATIBLES LTD (GB) 1998-06-10 EP claimed
WO-1995005408-A1 POLYMER SURFACE COATINGS BIOCOMPATIBLES LIMITED (GB) 1995-02-23 WO claimed
EP-0714417-B1 POLYMER SURFACE COATINGS BIOCOMPATIBLES LTD (GB) 1998-06-10 EP disclosed
EP-0714417-A1 POLYMER SURFACE COATINGS BIOCOMPATIBLES LIMITED (GB) 1996-06-05 EP disclosed
WO-1995005408-A1 POLYMER SURFACE COATINGS BIOCOMPATIBLES LIMITED (GB) 1995-02-23 WO disclosed