SCHEMBL11555157

SCHEMBL11555157

NS(=O)(=O)c1cc(S(=O)(=O)Oc2ccccc2)c(NCc2cccs2)cc1Oc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CISD1 Q9NZ45 1/20 0.48
▸ PDE4D Q08499 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ P2RX4 Q99571 1/20 0.37
▸ POLB P06746 2/20 0.36
▸ PTGS2 P35354 1/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ KDM4C Q9H3R0 1/20 0.34
▸ TSHR P16473 2/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ CA2 P00918 3/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ CA4 P22748 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ BLM P54132 1/20 0.34

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
SCHEMBL11556930 0.89 CISD1 (0.51) CISD1PDE4DPDE3AP2RX4POLB
SCHEMBL10964633 0.85 CA2 (0.44) CISD1P2RX4KDM4ETSHRCA2
SCHEMBL11708093 0.84 CISD1 (0.69) CISD1PDE4DPDE3AP2RX4POLB
SCHEMBL11223169 0.82 CISD1 (0.46) CISD1PDE4DPDE3APOLBPTGS2
SCHEMBL10968089 0.82 ALDH1A1 (0.48) CISD1P2RX4POLBKDM4EL3MBTL1
SCHEMBL11098356 0.81 CISD1 (0.43) CISD1PDE4DPDE3APOLBPTGS2
SCHEMBL11215820 0.80 CISD1 (0.43) CISD1PDE4DPDE3APOLBPTGS2
SCHEMBL11554943 0.80 CISD1 (0.46) CISD1PDE4DPDE3AP2RX4POLB
SCHEMBL11555741 0.71 P2RX4 (0.46) P2RX4SMN1; SMN2CA2TDP1CA4
Sulosemide SCHEMBL30704848 0.70 ALDH1A1 (0.51) CISD1P2RX4POLBKDM4EL3MBTL1

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
US-4161533-A DIURETICS, SALURETICS HOECHST AKTIENGESELLSCHAFT (DE) 1979-07-17 — — US disclosed
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