SCHEMBL11152136

SCHEMBL11152136

COC(=O)Oc1[nH]c2ccc(C)cc2c1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.46
KMT2A Q03164 6/20 0.46
NR4A2 P43354 1/20 0.43
ALDH1A1 P00352 12/20 0.42
KDM4E B2RXH2 10/20 0.42
MAPT P10636 9/20 0.42
PKM P14618 1/20 0.42
GAA P10253 5/20 0.41
HPGD P15428 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TP53 P04637 1/20 0.40
POLB P06746 1/20 0.40
HSD17B10 Q99714 4/20 0.40
ALOX15 P16050 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
RXFP1 Q9HBX9 1/20 0.40
HTT P42858 2/20 0.39
GFER P55789 2/20 0.39

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
SCHEMBL5771929 0.81 NR4A2 (0.42) MEN1KMT2ANR4A2ALDH1A1KDM4E
SCHEMBL5768460 0.80 PFKFB1 (0.41) MEN1KMT2ANR4A2ALDH1A1KDM4E
SCHEMBL10462854 0.77 KDM4E (0.57) MEN1KMT2ANR4A2ALDH1A1KDM4E
SCHEMBL9573828 0.75 GABRA1 (0.47) MEN1KMT2ANR4A2ALDH1A1KDM4E
SCHEMBL9573773 0.75 HPGD (0.49) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL9573800 0.75 TUBB4A (0.51) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL6291860 0.75 MEN1 (0.60) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL8809770 0.73 NR4A2 (0.49) MEN1KMT2ANR4A2ALDH1A1KDM4E
SCHEMBL31081242 0.72 HPGD (0.42) NR4A2KDM4EMAPTHPGDHSD17B10
SCHEMBL31081033 0.72 HPGD (0.42) NR4A2KDM4EMAPTHPGDHSD17B10

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-0071935-A2 1-Phenyl-2-aminocarbonylindole compounds, process and intermediates for their preparation and medicines containing them Kali-Chemie Pharma GmbH (DE) 1983-02-16 EP disclosed