SCHEMBL8902809

SCHEMBL8902809

O=S(=O)(O)c1c2c(cc3cc4c(cc13)CSC4)OCO2

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
RGS12 O14924 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ALOX5 P09917 1/20 0.30
ADORA2A P29274 1/20 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
SCHEMBL8903548 0.79 ALDH1A1 (0.30) ALDH1A1MAPT
SCHEMBL8903285 0.71 MEN1 (0.33)
SCHEMBL8903366 0.65 PDE1A (0.33) MAPT
SCHEMBL8903077 0.64 ACP1 (0.30)
SCHEMBL8903280 0.63 TTR (0.42) KDM4EALDH1A1ALOX15HSD17B10
SCHEMBL8904603 0.61
SCHEMBL8904385 0.61 ACP1 (0.30)
SCHEMBL8903404 0.61 ING2 (0.35)
SCHEMBL8903494 0.60 CYP2C19 (0.42) KDM4EALDH1A1CYP3A4MAPTHPGD
SCHEMBL22723642 0.59 PKM (0.33) KDM4EALDH1A1

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