SCHEMBL5782154

SCHEMBL5782154

CCn1c(N[C@H]2c3ccccc3C[C@@H]2OC(C)=O)c(C)nc(-c2ccc(OC)nc2OC)c1=O

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 12/20 0.43
BRD9 Q9H8M2 1/20 0.33
BRD7 Q9NPI1 1/20 0.33
NTRK1 P04629 3/20 0.32
FFAR2 O15552 1/20 0.32
CASR P41180 2/20 0.32
APLNR P35414 1/20 0.31

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
SCHEMBL5782157 1.00 CRHR1 (0.43) CRHR1BRD9BRD7NTRK1FFAR2
SCHEMBL6499773 1.00 CRHR1 (0.43) CRHR1BRD9BRD7NTRK1FFAR2
SCHEMBL5785205 0.94 CRHR1 (0.42) CRHR1NTRK1APLNR
SCHEMBL6498303 0.94 CRHR1 (0.42) CRHR1NTRK1APLNR
SCHEMBL5785202 0.94 CRHR1 (0.42) CRHR1NTRK1APLNR
SCHEMBL6498138 0.90 CRHR1 (0.44) CRHR1BRD9BRD7NTRK1
SCHEMBL6498553 0.90 CRHR1 (0.41) CRHR1BRD9BRD7NTRK1FFAR2
SCHEMBL5783443 0.90 CRHR1 (0.41) CRHR1BRD9BRD7NTRK1FFAR2
SCHEMBL5783440 0.90 CRHR1 (0.41) CRHR1BRD9BRD7NTRK1FFAR2
SCHEMBL5781075 0.87 CRHR1 (0.46) CRHR1APLNR

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-20050020601-A1 Novel pyrazinones as CRF1 receptor antagonists PFIZER INC 2005-01-27 US 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 1/4885BRD9 3792/4885BRD7 3101/4885

“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.