SCHEMBL3346965

SCHEMBL3346965

COC(=O)C1(C)Cc2ccccc2C1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.40
CYP3A4 P08684 5/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MAPT P10636 5/20 0.40
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 2/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
HBB P68871 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HTT P42858 1/20 0.39
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 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
SCHEMBL26605091 0.78 MAPT (0.37) TSHRCYP3A4POLBSMN1; SMN2NPSR1
SCHEMBL14429883 0.72 ALOX15 (0.44) TSHRCYP3A4MAPTALDH1A1KDM4E
SCHEMBL1745011 0.72 ALOX15 (0.44) TSHRCYP3A4MAPTALDH1A1KDM4E
SCHEMBL1470334 0.71 MEN1 (0.47) TSHRPOLBMAPTALDH1A1KDM4E
SCHEMBL17158279 0.70 BRD4 (0.46) TSHRCYP3A4POLBSMN1; SMN2NPSR1
SCHEMBL24162532 0.69 ALOX15 (0.42) TSHRCYP3A4MAPTALDH1A1KDM4E
SCHEMBL28207345 0.69 MAPT (0.34) TSHRMAPTALDH1A1KDM4EHPGD
SCHEMBL9527406 0.69 SLC6A2 (0.41) TSHRCYP3A4MAPTALDH1A1MEN1
SCHEMBL12203632 0.69 MEN1 (0.44) TSHRPOLBMAPTALDH1A1KDM4E
SCHEMBL10488163 0.68 MAPT (0.39) TSHRMAPTALDH1A1KDM4EHPGD

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-2010057865-A1 N- INDEN- 2 -YL- ISOPROPYLSULFONAMIDES AS AMPA RECEPTOR POTENTIATORS GLAXO GROUP LIMITED (GB) 2010-05-27 WO disclosed
WO-2010057865-A1 N- INDEN- 2 -YL- ISOPROPYLSULFONAMIDES AS AMPA RECEPTOR POTENTIATORS GLAXO GROUP LIMITED (GB) 2010-05-27 WO disclosed