SCHEMBL5785205

SCHEMBL5785205

CCn1c(N[C@@H]2c3ccccc3C[C@@H]2OC(C)=O)c(C)nc(-c2ccc(OC)nc2C)c1=O

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 10/20 0.42
APLNR P35414 1/20 0.34
NTRK1 P04629 3/20 0.33
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30

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
SCHEMBL5785202 1.00 CRHR1 (0.42) CRHR1APLNRNTRK1GABRA1GABRB2
SCHEMBL6498303 1.00 CRHR1 (0.42) CRHR1APLNRNTRK1GABRA1GABRB2
SCHEMBL5782157 0.94 CRHR1 (0.43) CRHR1APLNRNTRK1
SCHEMBL5782154 0.94 CRHR1 (0.43) CRHR1APLNRNTRK1
SCHEMBL6499773 0.94 CRHR1 (0.43) CRHR1APLNRNTRK1
SCHEMBL5781078 0.93 CRHR1 (0.46) CRHR1APLNR
SCHEMBL6503154 0.93 CRHR1 (0.46) CRHR1APLNR
SCHEMBL5781075 0.93 CRHR1 (0.46) CRHR1APLNR
SCHEMBL6497057 0.90 CRHR1 (0.43) CRHR1APLNRNTRK1
SCHEMBL5782595 0.90 CRHR1 (0.41) CRHR1APLNRNTRK1GABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1626965-A1 PYRAZINONES AS CRF1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CNS DISORDERS Pharmacia & Upjohn Company LLC (US) 2006-02-22 EP claimed
US-20050020601-A1 Novel pyrazinones as CRF1 receptor antagonists PFIZER INC 2005-01-27 US claimed
WO-2004099161-A1 PYRAZINONES AS CRF1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CNS DISORDERS PHARMACIA & UPJOHN COMPANY LLC (US) 2004-11-18 WO claimed
EP-1626965-A1 PYRAZINONES AS CRF1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CNS DISORDERS Pharmacia & Upjohn Company LLC (US) 2006-02-22 EP disclosed
US-20050020601-A1 Novel pyrazinones as CRF1 receptor antagonists PFIZER INC 2005-01-27 US disclosed
WO-2004099161-A1 PYRAZINONES AS CRF1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CNS DISORDERS PHARMACIA & UPJOHN COMPANY LLC (US) 2004-11-18 WO 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-20050020601-A1 Novel pyrazinones as CRF1 receptor antagonists CRHR1, CRHR2, CRH CRHR1 1/4885APLNR 348/4885NTRK1 433/4885

“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.