SCHEMBL28869011

SCHEMBL28869011

C=CS(=O)(=O)c1cc2c3c(cccc3c1)C(=O)N(c1ccccc1)C2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 3/20 0.50
▸ CA9 Q16790 3/20 0.50
▸ CA1 P00915 2/20 0.50
▸ CA2 P00918 2/20 0.50
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ CLTC Q00610 5/20 0.47
▸ ALDH1A1 P00352 5/20 0.45
▸ KDM4E B2RXH2 4/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ KMT2A Q03164 3/20 0.44
▸ POLB P06746 2/20 0.43
▸ APOBEC3A P31941 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ CASP6 P55212 1/20 0.43
▸ APOBEC3G Q9HC16 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ MAPT P10636 3/20 0.42
▸ HTT P42858 3/20 0.42

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
SCHEMBL299841 0.76 ALDH1A1 (0.71) CA12CA9CA1CA2L3MBTL1
SCHEMBL9693019 0.74 ESR1 (0.58) CA12CA9CA1CA2L3MBTL1
SCHEMBL22600682 0.74 KMT2A (0.71) CA12CA9CA1CA2L3MBTL1
SCHEMBL28769329 0.74 CA12 (0.49) CA12CA9CA1CA2L3MBTL1
SCHEMBL14652571 0.72 CLTC (0.50) CA12CA9L3MBTL1RXFP1CLTC
SCHEMBL9290293 0.71 PDE6D (0.55) CA12CA9CA1CA2L3MBTL1
SCHEMBL717142 0.70 CA12 (0.74) CA12CA9CA1CA2L3MBTL1
SCHEMBL5154497 0.70 CA12 (0.60) CA12CA9CA1CA2L3MBTL1
SCHEMBL20735193 0.69 ALDH1A1 (0.82) CA12CA9CA1CA2L3MBTL1
SCHEMBL7848586 0.69 ERCC1 (0.62) CA12CA9CA1CA2CLTC

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
CN-109219436-A modified wound dressing 康沃特克科技公司 2019-01-15 — — CN disclosed
Send feedback