SCHEMBL7529358

SCHEMBL7529358

Cn1cc(C2=C(c3cccc(OC[C@@H](O)CO)c3)C(=O)NC2=O)c2ccccc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 11/20 0.72
PRKCA P17252 8/20 0.72
CDK2 P24941 2/20 0.62
CCNE2 O96020 1/20 0.62
CDK4 P11802 1/20 0.62
CCND1 P24385 1/20 0.62
CCNE1 P24864 1/20 0.62
PLK4 O00444 1/20 0.55
AURKA O14965 1/20 0.55
STK16 O75716 1/20 0.55
EIF2AK2 P19525 1/20 0.55
MAPK3 P27361 1/20 0.55
MAPK1 P28482 1/20 0.55
MAPK4 P31152 1/20 0.55
TTK P33981 1/20 0.55
CDK8 P49336 1/20 0.55
CLK1 P49759 1/20 0.55
CLK2 P49760 1/20 0.55
CLK3 P49761 1/20 0.55
GSK3A P49840 1/20 0.55

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
SCHEMBL7541680 1.00 GSK3B (0.72) GSK3BPRKCACDK2CCNE2CDK4
SCHEMBL7522211 0.89 CCNE2 (0.65) GSK3BPRKCACDK2CCNE2CDK4
SCHEMBL6586550 0.89 GSK3B (0.73) GSK3BPRKCACDK2CCNE2CDK4
SCHEMBL6584784 0.89 GSK3B (0.70) GSK3BPRKCACDK2CCNE2CDK4
SCHEMBL7522437 0.83 CCNE2 (0.67) GSK3BPRKCACDK2CCNE2CDK4
SCHEMBL4430981 0.83 CCNE2 (0.57) GSK3BPRKCACDK2CCNE2CDK4
SCHEMBL4430984 0.83 CCNE2 (0.57) GSK3BPRKCACDK2CCNE2CDK4
SCHEMBL4430976 0.83 CCNE2 (0.57) GSK3BPRKCACDK2CCNE2CDK4
SCHEMBL6583362 0.82 GSK3B (1.00) GSK3BPRKCACDK2CCNE2CDK4
SCHEMBL6584610 0.82 CCNE2 (0.63) GSK3BPRKCACDK2CCNE2CDK4

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-20020188018-A1 3-indolyl-4-phenyl-1H-pyrrole-2,5-dione derivatives as inhibitors of glycogen synthase kinase-3beta GONG LEYI (US) 2002-12-12 US disclosed
US-20020052397-A1 3-indolyl-4-phenyl-1H-pyrrole-2,5-dione derivatives as inhibitors of glycogen synthase kinase-3beta SYNTEX (U.S.A.) LLC 2002-05-02 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 (2 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-20020052397-A1 3-indolyl-4-phenyl-1H-pyrrole-2,5-dione derivatives as inhibitors of glycogen synthase kinase-3beta GSK3B, GSK3A, PYGL GSK3B 1/4885PRKCA 61/4885CDK2 102/4885
US-20020188018-A1 3-indolyl-4-phenyl-1H-pyrrole-2,5-dione derivatives as inhibitors of glycogen synthase kinase-3beta GSK3B, GSK3A, PYGL GSK3B 1/4885PRKCA 62/4885CDK2 206/4885

“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.