SCHEMBL2015999

SCHEMBL2015999

Cc1c(C(=O)OCCN(C)C)[nH]c2c1C(=O)CC(c1ccco1)C2

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.79
POLB P06746 13/20 0.79
PKM P14618 11/20 0.79
L3MBTL1 Q9Y468 10/20 0.79
LMNA P02545 10/20 0.79
MAPK1 P28482 9/20 0.79
HSD17B10 Q99714 7/20 0.79
TDP1 Q9NUW8 7/20 0.79
NPSR1 Q6W5P4 7/20 0.79
ESR1 P03372 5/20 0.79
RECQL P46063 4/20 0.79
APEX1 P27695 3/20 0.79
ALOX15 P16050 2/20 0.79
BLM P54132 2/20 0.79
TSHR P16473 7/20 0.79
MEN1 O00255 3/20 0.79
KMT2A Q03164 3/20 0.79
HTT P42858 3/20 0.79
MCL1 Q07820 1/20 0.79
SMN1; SMN2 Q16637 12/20 0.77

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
SCHEMBL2016219 0.89 SMN1; SMN2 (0.87) ALDH1A1POLBPKML3MBTL1LMNA
SCHEMBL2016888 0.89 POLB (0.84) ALDH1A1POLBPKML3MBTL1LMNA
SCHEMBL2015528 0.89 ALDH1A1 (0.71) ALDH1A1POLBPKML3MBTL1LMNA
SCHEMBL2015501 0.89 POLB (1.00) ALDH1A1POLBPKML3MBTL1LMNA
SCHEMBL2014912 0.88 POLB (1.00) ALDH1A1POLBPKML3MBTL1LMNA
SCHEMBL2017148 0.87 POLB (0.79) ALDH1A1POLBPKML3MBTL1LMNA
SCHEMBL2015769 0.87 SMN1; SMN2 (1.00) ALDH1A1POLBPKML3MBTL1LMNA
SCHEMBL2017482 0.87 POLB (0.85) ALDH1A1POLBPKML3MBTL1LMNA
SCHEMBL2020989 0.87 SMN1; SMN2 (1.00) ALDH1A1POLBPKML3MBTL1LMNA
SCHEMBL2016403 0.86 POLB (0.81) ALDH1A1POLBPKML3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011073929-A1 6-(2-FURYL)-3-METHYL-4-OXO-1,5,6,7-TETRAHYDROINDOLE-2-CARBOXYLATE DERIVATIVES AND USES THEREOF ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2011-06-23 WO claimed
WO-2011073929-A1 6-(2-FURYL)-3-METHYL-4-OXO-1,5,6,7-TETRAHYDROINDOLE-2-CARBOXYLATE DERIVATIVES AND USES THEREOF ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2011-06-23 WO disclosed
WO-2011073929-A1 6-(2-FURYL)-3-METHYL-4-OXO-1,5,6,7-TETRAHYDROINDOLE-2-CARBOXYLATE DERIVATIVES AND USES THEREOF ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2011-06-23 WO disclosed