SCHEMBL11433833

SCHEMBL11433833

O=C(O)CCc1cc(=O)n(-c2ccc(S(=O)(=O)O)cc2)[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.43
▸ ALKBH5 Q6P6C2 9/20 0.40
▸ MAPT P10636 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ APEX1 P27695 1/20 0.38
▸ KDM5A P29375 1/20 0.37
▸ KDM2B Q8NHM5 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ KDM5B Q9UGL1 1/20 0.37
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ GAA P10253 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ HTT P42858 2/20 0.35
▸ LMNA P02545 2/20 0.35

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
SCHEMBL9836343 0.86 TSHR (0.41) TSHRALKBH5MAPTKMT2ASMN1; SMN2
SCHEMBL11424543 0.83 TSHR (0.59) TSHRALKBH5MAPTKMT2ASMN1; SMN2
SCHEMBL11423991 0.82 ALDH1A1 (0.44) TSHRMAPTKMT2AKDM4EALDH1A1
SCHEMBL11532835 0.81 TSHR (0.41) TSHRALKBH5MAPTKMT2ASMN1; SMN2
SCHEMBL67421 0.76 ALKBH5 (0.66) ALKBH5MAPTKMT2ASMN1; SMN2KDM4E
SCHEMBL11438802 0.75 KDM4C (0.33) TSHRMAPTKMT2AALDH1A1KDM5A
SCHEMBL10444620 0.74 ALDH1A1 (0.46) TSHRALKBH5MAPTKMT2ASMN1; SMN2
SCHEMBL11642423 0.74 ALDH1A1 (0.46) TSHRALKBH5MAPTKMT2ASMN1; SMN2
SCHEMBL1734462 0.73 CYP2C19 (0.43) TSHRALKBH5MAPTKMT2ASMN1; SMN2
SCHEMBL395368 0.73 ALDH1A1 (0.66) ALKBH5MAPTKMT2ASMN1; SMN2KDM4E

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-4221709-A Azo pigments DAINICHISEIKA COLOR & CHEMICALS MFG. CO., LTD. (JP) 1980-09-09 — — US disclosed
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