SCHEMBL8807829

SCHEMBL8807829

Cc1cc(=O)oc2c(S(=O)(=O)O)c(N)ccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 7/20 0.56
▸ GAA P10253 5/20 0.56
▸ GFER P55789 1/20 0.56
▸ KDM4E B2RXH2 7/20 0.51
▸ MCL1 Q07820 4/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ MAOB P27338 3/20 0.51
▸ LMNA P02545 3/20 0.51
▸ MAPK1 P28482 2/20 0.51
▸ MGAM O43451 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ SI P14410 1/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ MGAM2 Q2M2H8 1/20 0.51
▸ ERN1 O75460 1/20 0.51
▸ CYP1A2 P05177 4/20 0.47
▸ ALPL P05186 3/20 0.47
▸ TSHR P16473 2/20 0.47

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
SCHEMBL8816527 0.76 KDM4E (0.39) HSD17B10GAAGFERKDM4EMCL1
SCHEMBL8814191 0.73 KDM4E (0.44) HSD17B10GAAKDM4EMCL1ALDH1A1
SCHEMBL17716513 0.73 HSD17B10 (0.55) HSD17B10GAAGFERKDM4EMCL1
SCHEMBL4929255 0.72 HSD17B10 (0.55) HSD17B10GAAGFERKDM4EMCL1
SCHEMBL8724340 0.72 GAA (1.00) HSD17B10GAAGFERKDM4EMCL1
SCHEMBL28213200 0.71 KMT2A (0.58) HSD17B10GAAGFERKDM4EMCL1
SCHEMBL31331777 0.71 MCL1 (0.70) HSD17B10GAAGFERKDM4EMCL1
SCHEMBL8809669 0.70 ESR2 (0.38) GAAKDM4EMCL1ALDH1A1LMNA
SCHEMBL4927312 0.70 PDE4D (0.52) HSD17B10GAAGFERKDM4EMCL1
SCHEMBL14511067 0.69 KDM4E (0.53) HSD17B10GAAKDM4EMCL1ALDH1A1

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-5696157-A Sulfonated derivatives of 7-aminocoumarin MOLECULAR PROBES, INC. (US) 1997-12-09 — — US disclosed
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