SCHEMBL8903643

SCHEMBL8903643

COC(=O)c1cc2c(cc1S(=O)(=O)O)CSC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 1/20 0.39
CA2 P00918 5/20 0.37
CA1 P00915 3/20 0.37
CA9 Q16790 3/20 0.37
CA5A P35218 1/20 0.37
KDM4E B2RXH2 8/20 0.34
HPGD P15428 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
RAB9A P51151 2/20 0.34
KMT2A Q03164 2/20 0.34
HSD17B10 Q99714 2/20 0.34
NPC1 O15118 1/20 0.34
MAPK1 P28482 1/20 0.34
CA12 O43570 2/20 0.33
CA7 P43166 2/20 0.33
CA14 Q9ULX7 2/20 0.33
PDK2 Q15119 1/20 0.33
PDK4 Q16654 1/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 3/20 0.33

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
SCHEMBL11760833 0.78 CDK1 (0.46) CDK1CA2CA1CA9CA5A
SCHEMBL8903404 0.77 ING2 (0.35)
SCHEMBL8904163 0.76 PRMT1 (0.35) CA2KDM4EHPGDSMN1; SMN2KMT2A
SCHEMBL2881079 0.76 MAPT (0.41) CA2CA1KMT2ACA7ALDH1A1
SCHEMBL2880285 0.73 BRD4 (0.38) KMT2AALDH1A1MAPTGAA
SCHEMBL3283445 0.72 CDK1 (0.42) CDK1CA2CA1CA9CA5A
SCHEMBL8904001 0.72 ALDH1A1 (0.42) KDM4EHPGDKMT2AALDH1A1MAPT
SCHEMBL2885617 0.70 LMNA (0.33) HPGDHSD17B10
SCHEMBL2884897 0.69 L3MBTL1 (0.33) CA2CA1CA9CA5ACA12
SCHEMBL8904514 0.69 TTR (0.35) HSD17B10ALDH1A1TDP1CASP1CASP7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5688873-A POLYISOBENZOTHIOPHENE, POLYISOBENZOFURAN, POLYISOINDOLE AND RELATED POLYMERS, AROMATIC RESINS, SULFONATE GROUP, WATER SOLUBILITY SHOWA DENKO K.K. (JP) 1997-11-18 US disclosed
US-5648453-A Electroconductive polymer and process for producing the polymer SHOWA DENKO K.K. (JP) 1997-07-15 US disclosed