SCHEMBL15907938

SCHEMBL15907938

O=S1(=O)c2cc(-c3cccnc3)ccc2-c2c1c1c(c3c2S(=O)(=O)c2cc(-c4cccnc4)ccc2-3)S(=O)(=O)c2cc(-c3cccnc3)ccc2-1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 7/20 0.48
CYP11B2 P19099 7/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2A6 P11509 2/20 0.46
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.46
ERN1 O75460 1/20 0.46
CYP19A1 P11511 4/20 0.45
CYP17A1 P05093 1/20 0.45
TDP2 O95551 2/20 0.44
PIK3CA P42336 1/20 0.43
MKNK1 Q9BUB5 2/20 0.42
MKNK2 Q9HBH9 2/20 0.42
MEN1 O00255 1/20 0.42
PSIP1 O75475 1/20 0.42
AXL P30530 1/20 0.42
QPCT Q16769 1/20 0.42
QPCTL Q9NXS2 1/20 0.42
KMO O15229 1/20 0.42
SLC2A1 P11166 1/20 0.41

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
SCHEMBL15907939 0.80 MEN1 (0.43) TDP2MEN1
SCHEMBL5801828 0.78 CHEK1 (0.54) CYP11B1CYP11B2CYP1A2ALDH1A1CYP19A1
SCHEMBL12231011 0.70 CYP11B1 (0.59) CYP11B1CYP11B2CYP1A2CYP2A6ALDH1A1
SCHEMBL7133253 0.70 CYP1A2 (0.46) CYP11B1CYP11B2CYP1A2CYP2A6ALDH1A1
SCHEMBL22130973 0.69 CYP11B1 (0.44) CYP11B1CYP11B2CYP1A2CYP2A6CYP19A1
SCHEMBL30620885 0.68 CYP2A6 (0.79) CYP11B1CYP11B2CYP1A2CYP2A6ALDH1A1
SCHEMBL12103445 0.68 CYP2A6 (0.79) CYP11B1CYP11B2CYP1A2CYP2A6ALDH1A1
SCHEMBL17951830 0.68 CYP2A6 (0.79) CYP11B1CYP11B2CYP1A2CYP2A6ALDH1A1
SCHEMBL24534338 0.68 CYP2A6 (0.88) CYP11B1CYP11B2CYP1A2CYP2A6ALDH1A1
SCHEMBL29360677 0.68 CYP2A6 (0.88) CYP11B1CYP11B2CYP1A2CYP2A6ALDH1A1

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
US-20140209867-A1 Sulfonyl Group-Contained Compound and Organic Electroluminescent Device Using Sulfonyl Group-Contained Compound and Preparation Method Thereof SHENZHEN CHINA STAR OPTOELECTRONICS TECHNOLOGY CO., LTD. (CN) 2014-07-31 US disclosed
US-20140209867-A1 Sulfonyl Group-Contained Compound and Organic Electroluminescent Device Using Sulfonyl Group-Contained Compound and Preparation Method Thereof SHENZHEN CHINA STAR OPTOELECTRONICS TECHNOLOGY CO., LTD. (CN) 2014-07-31 US disclosed