SCHEMBL3718026

SCHEMBL3718026

O=Cc1cccnc1S(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRIM24 O15164 2/20 0.50
▸ TRIM33 Q9UPN9 2/20 0.50
▸ KMT2A Q03164 3/20 0.46
▸ ERN1 O75460 3/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ IDO1 P14902 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ COMT P21964 1/20 0.41
▸ LMNA P02545 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ ALOX15 P16050 1/20 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
SCHEMBL8410576 0.83 TDP1 (0.37) TRIM24TRIM33ERN1KDM4EL3MBTL1
SCHEMBL9782052 0.81 TRIM24 (0.50) TRIM24TRIM33KMT2AERN1KDM4E
Butadiene SCHEMBL10799164 0.80 TDP1 (0.35) TRIM24TRIM33ERN1KDM4EL3MBTL1
SCHEMBL30107073 0.78 TRIM24 (0.47) TRIM24TRIM33KMT2AERN1KDM4E
SCHEMBL1464976 0.77 KMT2A (0.54) TRIM24TRIM33KMT2AERN1KDM4E
SCHEMBL29564068 0.74 COMT (0.49) KMT2AKDM4EMEN1L3MBTL1COMT
SCHEMBL2112972 0.74 COMT (0.49) KMT2AKDM4EMEN1L3MBTL1COMT
SCHEMBL28502273 0.74 NFE2L2 (0.43) KDM4ECOMTLMNANFE2L2NAPRT
SCHEMBL7081072 0.74 KDM4E (0.53) KMT2AERN1KDM4EMEN1L3MBTL1
SCHEMBL1465505 0.73 NFE2L2 (0.61) NFE2L2

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
WO-2010142934-A1 INDOLE DERIVATIVES AS LIGANDS OF CRTH2 RECEPTORS PULMAGEN THERAPEUTICS (ASTHMA) LIMITED (GB) 2010-12-16 — — WO disclosed
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