SCHEMBL2016385

SCHEMBL2016385

Cc1ccc(COC(=O)c2[nH]c3c(c2C)C(=O)CC(c2ccco2)C3)cc1

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 13/20 0.88
SMN1; SMN2 Q16637 12/20 0.88
ALDH1A1 P00352 11/20 0.88
PKM P14618 11/20 0.88
L3MBTL1 Q9Y468 10/20 0.88
LMNA P02545 8/20 0.88
MAPT P10636 8/20 0.88
HSD17B10 Q99714 7/20 0.88
TSHR P16473 7/20 0.88
TDP1 Q9NUW8 6/20 0.88
NPSR1 Q6W5P4 5/20 0.88
ESR1 P03372 5/20 0.88
RECQL P46063 4/20 0.88
MEN1 O00255 3/20 0.88
KMT2A Q03164 3/20 0.88
APEX1 P27695 3/20 0.88
ESR2 Q92731 1/20 0.88
ALOX15 P16050 2/20 0.79
HTT P42858 2/20 0.79
MCL1 Q07820 1/20 0.79

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
SCHEMBL2016203 0.93 POLB (1.00) POLBSMN1; SMN2ALDH1A1PKML3MBTL1
SCHEMBL2014912 0.88 POLB (1.00) POLBSMN1; SMN2ALDH1A1PKML3MBTL1
SCHEMBL2016219 0.85 SMN1; SMN2 (0.87) POLBSMN1; SMN2ALDH1A1PKML3MBTL1
SCHEMBL2016888 0.85 POLB (0.84) POLBSMN1; SMN2ALDH1A1PKML3MBTL1
SCHEMBL2019581 0.85 POLB (1.00) POLBSMN1; SMN2ALDH1A1PKML3MBTL1
SCHEMBL2015501 0.85 POLB (1.00) POLBSMN1; SMN2ALDH1A1PKML3MBTL1
SCHEMBL2016416 0.84 POLB (0.80) POLBSMN1; SMN2ALDH1A1PKML3MBTL1
SCHEMBL2020480 0.84 ALDH1A1 (1.00) POLBSMN1; SMN2ALDH1A1PKML3MBTL1
SCHEMBL2021255 0.83 POLB (0.83) POLBSMN1; SMN2ALDH1A1PKML3MBTL1
SCHEMBL2013696 0.83 ALDH1A1 (1.00) POLBSMN1; SMN2ALDH1A1PKML3MBTL1

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
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