SCHEMBL7239971

SCHEMBL7239971

CCn1c(-c2cnc(N(C)C)cc2C)nc(C)c(N[C@H]2c3ccccc3C[C@@H]2OC(C)=O)c1=O

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 16/20 0.43
ABL1 P00519 1/20 0.33
PIK3CA P42336 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
SCHEMBL7239965 1.00 CRHR1 (0.43) CRHR1ABL1PIK3CA
SCHEMBL6634750 1.00 CRHR1 (0.43) CRHR1ABL1PIK3CA
SCHEMBL7243021 0.93 CRHR1 (0.46) CRHR1
SCHEMBL7243025 0.93 CRHR1 (0.46) CRHR1
SCHEMBL7243029 0.93 CRHR1 (0.46) CRHR1
SCHEMBL7244915 0.90 CRHR1 (0.41) CRHR1ABL1PIK3CA
SCHEMBL7245181 0.90 CRHR1 (0.43) CRHR1
SCHEMBL7244912 0.90 CRHR1 (0.41) CRHR1ABL1PIK3CA
SCHEMBL7244919 0.90 CRHR1 (0.41) CRHR1ABL1PIK3CA
SCHEMBL5787588 0.87 CRHR1 (0.42) CRHR1ABL1PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030195222-A1 Substituted pyrimidinones and pyrimidinthiones PHARMACIA & UPJOHN COMPANY 2003-10-16 US claimed

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-20030195222-A1 Substituted pyrimidinones and pyrimidinthiones CRHR1, CRH, CRHR2 CRHR1 1/4885ABL1 1018/4885PIK3CA 2770/4885

“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.