SCHEMBL6496402

SCHEMBL6496402

CC(=O)OC1Cc2ccccc2C1Nc1c(C)nc(-c2cnc(N(C)C)cc2C)c(=O)n1C

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 3/20 0.40
ABL1 P00519 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
PIK3CA P42336 1/20 0.31
SMO Q99835 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
SCHEMBL5780518 1.00 CRHR1 (0.40) CRHR1ABL1CYP3A4CYP2C9PIK3CA
SCHEMBL5780516 1.00 CRHR1 (0.40) CRHR1ABL1CYP3A4CYP2C9PIK3CA
SCHEMBL6508023 0.91 CRHR1 (0.46) CRHR1
SCHEMBL5785022 0.91 CRHR1 (0.46) CRHR1
SCHEMBL5785025 0.91 CRHR1 (0.46) CRHR1
SCHEMBL6496447 0.90 CRHR1 (0.42) CRHR1ABL1PIK3CA
SCHEMBL5787587 0.90 CRHR1 (0.42) CRHR1ABL1PIK3CA
SCHEMBL5787588 0.90 CRHR1 (0.42) CRHR1ABL1PIK3CA
SCHEMBL6498701 0.88 CRHR1 (0.42) CRHR1
SCHEMBL7244912 0.86 CRHR1 (0.41) CRHR1ABL1CYP3A4CYP2C9PIK3CA

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-20050020601-A1 Novel pyrazinones as CRF1 receptor antagonists PFIZER INC 2005-01-27 US claimed
US-20050020601-A1 Novel pyrazinones as CRF1 receptor antagonists PFIZER INC 2005-01-27 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-20050020601-A1 Novel pyrazinones as CRF1 receptor antagonists CRHR1, CRHR2, CRH CRHR1 1/4885ABL1 4315/4885CYP3A4 1513/4885

“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.