SCHEMBL8615019

SCHEMBL8615019

C=Cc1ccc(S(=O)(=O)c2ccc(C=C)c3ccccc23)c2ccccc12

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LDHA P00338 1/20 0.37
ALPL P05186 1/20 0.37
ALPI P09923 1/20 0.37
ALPG P10696 1/20 0.37
DNMT1 P26358 1/20 0.37
MCL1 Q07820 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALDH1A1 P00352 3/20 0.34
GAA P10253 1/20 0.34
HTR6 P50406 7/20 0.33
BCL2 P10415 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
TSHR P16473 2/20 0.30

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
SCHEMBL30192595 0.85 TTR (0.46) LDHATDP1ALDH1A1MEN1KMT2A
SCHEMBL9810944 0.85 ALDH1A1 (0.39) LDHATDP1ALDH1A1
SCHEMBL313414 0.85 TTR (0.46) LDHATDP1ALDH1A1MEN1KMT2A
SCHEMBL313901 0.83 THRB (0.44) LDHATDP1ALDH1A1TSHR
SCHEMBL313902 0.83 TTR (0.44) LDHATDP1ALDH1A1MEN1KMT2A
SCHEMBL313915 0.80 ALDH1A1 (0.33) LDHAMCL1ALDH1A1
SCHEMBL2100602 0.80 ALDH1A1 (0.48) TDP1ALDH1A1GAAMEN1KMT2A
SCHEMBL29434197 0.80 ALDH1A1 (0.48) TDP1ALDH1A1GAAMEN1KMT2A
SCHEMBL9810946 0.79 MCL1 (0.33) ALPLALPIALPGDNMT1MCL1
SCHEMBL24791578 0.77 MEN1 (0.43) TDP1L3MBTL1ALDH1A1MEN1KMT2A

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
EP-0581898-B1 POLYANILINE COMPOSITIONS HAVING A SURFACE/CORE DOPANT ARRANGEMENT ZIPPERLING KESSLER & CO (DE) 1999-03-03 EP claimed