SCHEMBL4553083

SCHEMBL4553083

CC(C)c1ccccc1Oc1ccc(C=C2SC(=S)NC2=O)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 3/20 0.68
MMP13 P45452 3/20 0.68
CSNK2A2 P19784 1/20 0.60
CLK1 P49759 1/20 0.60
CSNK2B P67870 1/20 0.60
CSNK2A1 P68400 1/20 0.60
DYRK1A Q13627 1/20 0.60
DYRK1B Q9Y463 1/20 0.60
MYC P01106 1/20 0.60
MAX P61244 1/20 0.60
NAT1 P18440 4/20 0.56
CA2 P00918 1/20 0.56
EPHX1 P07099 1/20 0.56
MEN1 O00255 2/20 0.56
RAB9A P51151 2/20 0.56
KMT2A Q03164 2/20 0.56
PIM1 P11309 1/20 0.56
ADAMTS5 Q9UNA0 2/20 0.54
AKR1B1 P15121 1/20 0.53
HPGD P15428 1/20 0.53

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
SCHEMBL4553082 1.00 MMP3 (0.68) MMP3MMP13CSNK2A2CLK1CSNK2B
SCHEMBL18103063 0.82 MMP3 (0.73) MMP3MMP13CSNK2A2CLK1CSNK2B
SCHEMBL8177661 0.81 MMP3 (1.00) MMP3MMP13CSNK2A2CLK1CSNK2B
SCHEMBL8177658 0.81 MMP3 (1.00) MMP3MMP13CSNK2A2CLK1CSNK2B
SCHEMBL18103088 0.81 MMP3 (1.00) MMP3MMP13CSNK2A2CLK1CSNK2B
SCHEMBL7969788 0.79 MMP3 (0.67) MMP3MMP13CSNK2A2CLK1CSNK2B
SCHEMBL7969787 0.79 MMP3 (0.67) MMP3MMP13CSNK2A2CLK1CSNK2B
SCHEMBL13479540 0.78 CSNK2A2 (0.72) MMP3MMP13CSNK2A2CLK1CSNK2B
SCHEMBL8172245 0.78 CSNK2A2 (0.72) MMP3MMP13CSNK2A2CLK1CSNK2B
SCHEMBL8172247 0.78 CSNK2A2 (0.72) MMP3MMP13CSNK2A2CLK1CSNK2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580832-B2 Substituted phenoxy aminothiazolones as estrogen related receptor-α modulators JANSSEN PHARMACEUTICA N.V. (BE) 2013-11-12 US disclosed
EP-2134698-A1 SUBSTITUTED PHENOXY AMINOTHIAZOLONES AS ESTROGEN RELATED RECEPTOR-ALPHA MODULATORS Janssen Pharmaceutica, N.V. (BE) 2009-12-23 EP disclosed
WO-2008109737-A1 SUBSTITUTED PHENOXY AMINOTHIAZOLONES AS ESTROGEN RELATED RECEPTOR-ALPHA MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-12 WO disclosed
US-20080221179-A1 SUBSTITUTED PHENOXY AMINOTHIAZOLONES as estrogen related receptor-alpha modulators JANSSEN PHARMACEUTICA N.V. (BE) 2008-09-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080221179-A1 SUBSTITUTED PHENOXY AMINOTHIAZOLONES as estrogen related receptor-alpha modulators ESR2, ESRRA, ESRRG MMP3 2058/4885MMP13 1186/4885CSNK2A2 606/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.