SCHEMBL2017148

SCHEMBL2017148

CNCCOC(=O)c1[nH]c2c(c1C)C(=O)CC(c1ccco1)C2

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 13/20 0.79
ALDH1A1 P00352 11/20 0.79
PKM P14618 11/20 0.79
L3MBTL1 Q9Y468 10/20 0.79
LMNA P02545 10/20 0.79
HSD17B10 Q99714 7/20 0.79
MAPK1 P28482 7/20 0.79
NPSR1 Q6W5P4 7/20 0.79
TDP1 Q9NUW8 6/20 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
KMT2A Q03164 4/20 0.79
MEN1 O00255 3/20 0.79
HTT P42858 3/20 0.79
MCL1 Q07820 1/20 0.79
SMN1; SMN2 Q16637 13/20 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
Hydrochloric Acid SCHEMBL2019174 0.99 POLB (0.78) POLBALDH1A1PKML3MBTL1LMNA
SCHEMBL2016219 0.89 SMN1; SMN2 (0.87) POLBALDH1A1PKML3MBTL1LMNA
SCHEMBL2016888 0.89 POLB (0.84) POLBALDH1A1PKML3MBTL1LMNA
SCHEMBL2015501 0.89 POLB (1.00) POLBALDH1A1PKML3MBTL1LMNA
SCHEMBL2014912 0.88 POLB (1.00) POLBALDH1A1PKML3MBTL1LMNA
SCHEMBL2017482 0.87 POLB (0.85) POLBALDH1A1PKML3MBTL1LMNA
SCHEMBL2020989 0.87 SMN1; SMN2 (1.00) POLBALDH1A1PKML3MBTL1LMNA
SCHEMBL2015769 0.87 SMN1; SMN2 (1.00) POLBALDH1A1PKML3MBTL1LMNA
SCHEMBL2015999 0.87 ALDH1A1 (0.79) POLBALDH1A1PKML3MBTL1LMNA
SCHEMBL2016416 0.86 POLB (0.80) POLBALDH1A1PKML3MBTL1LMNA

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