SCHEMBL6505939

SCHEMBL6505939

CCO[C@H]1Cc2ccccc2[C@H]1Nc1c(C)nc(-c2ccc(OC)cc2Cl)c(=O)n1CC

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 13/20 0.40
NPBWR1 P48145 1/20 0.35
NTRK1 P04629 2/20 0.34
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
CDC7 O00311 1/20 0.33
DBF4 Q9UBU7 1/20 0.33

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
SCHEMBL6505875 0.92 CRHR1 (0.45) CRHR1NPBWR1
SCHEMBL6506702 0.91 CRHR1 (0.41) CRHR1NPBWR1NTRK1CDC7DBF4
SCHEMBL6503435 0.91 CRHR1 (0.41) CRHR1NTRK1
SCHEMBL5783846 0.90 CRHR1 (0.41) CRHR1NPBWR1NTRK1POLBHTT
SCHEMBL5783841 0.90 CRHR1 (0.41) CRHR1NPBWR1NTRK1POLBHTT
SCHEMBL6500940 0.90 CRHR1 (0.41) CRHR1NPBWR1NTRK1POLBHTT
SCHEMBL6506804 0.88 CRHR1 (0.40) CRHR1NTRK1
SCHEMBL6109586 0.86 CRHR1 (0.41) CRHR1NPBWR1
SCHEMBL6497057 0.85 CRHR1 (0.43) CRHR1NTRK1
SCHEMBL6498818 0.84 CRHR1 (0.45) CRHR1NPBWR1

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 1/4885NPBWR1 77/4885NTRK1 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.