SCHEMBL1613573

SCHEMBL1613573

COCc1cc(OC)c(-c2c(SC)sc3c(N(C(=O)O)C(C)(C)C)c(C)nn23)c(OC)c1

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 20/20 0.69

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
SCHEMBL11903721 0.83 CRHR1 (0.65) CRHR1
SCHEMBL1613049 0.81 CRHR1 (1.00) CRHR1
SCHEMBL11920553 0.80 CRHR1 (0.59) CRHR1
SCHEMBL1614250 0.80 CRHR1 (0.46) CRHR1
SCHEMBL1614268 0.79 CRHR1 (0.46) CRHR1
SCHEMBL1613880 0.79 CRHR1 (0.52) CRHR1
SCHEMBL12712825 0.76 CRHR1 (0.65) CRHR1
SCHEMBL1613375 0.76 CRHR1 (0.85) CRHR1
SCHEMBL1613290 0.76 CRHR1 (0.57) CRHR1
SCHEMBL1660757 0.73 CRHR1 (0.39) CRHR1

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-8530504-B2 Pyrazolothiazole compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-09-10 US disclosed
US-20110086882-A1 PYRAZOLOTHIAZOLE COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-04-14 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-20110086882-A1 PYRAZOLOTHIAZOLE COMPOUND CRHR1, CNR1, AGTR1 CRHR1 1/4885

“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.