SCHEMBL5576492

SCHEMBL5576492

COC(=O)c1c(O)c2cc(Cl)c(Cl)cc2c(=O)n1CC(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 13/20 0.37
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KRAS P01116 1/20 0.34
MAPK14 Q16539 1/20 0.34
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL5576641 0.89 GABRA1 (0.36) POLBGAANPSR1KRASALDH1A1
SCHEMBL5576892 0.86 PDE3B (0.39) MAPK8POLBGAANPSR1KDM4E
SCHEMBL5576873 0.85 DPP4 (0.36) POLBGAANPSR1KRASALDH1A1
SCHEMBL5576340 0.77 CCR2 (0.46) POLBGAANPSR1KRASKDM4E
SCHEMBL5577131 0.77 GABRA1 (0.35) POLBGAANPSR1KRASKDM4E
SCHEMBL5236394 0.74 KDM4E (0.46) GAAKDM4EALDH1A1LMNAMAPT
SCHEMBL5235788 0.72 KDM4E (0.41) MAPK8GAANPSR1KDM4EALDH1A1
SCHEMBL5234504 0.71 PTGDR2 (0.39)
SCHEMBL5236477 0.70 TNF (0.40) POLBGAANPSR1KDM4EALDH1A1
SCHEMBL5236533 0.70 ALDH1A1 (0.41) GAAKDM4EALDH1A1MAPTHPGD

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-20070117840-A1 Receptor antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-05-24 US claimed
EP-1604983-A1 RECEPTOR ANTAGONIST Takeda Pharmaceutical Company Limited (JP) 2005-12-14 EP claimed
US-20070117840-A1 Receptor antagonist TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-05-24 US disclosed
EP-1604983-A1 RECEPTOR ANTAGONIST Takeda Pharmaceutical Company Limited (JP) 2005-12-14 EP 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-20070117840-A1 Receptor antagonist FSHR, NR4A1, GHRHR MAPK8 1528/4885POLB 3882/4885GAA 4885/4885

“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.