SCHEMBL6345576

SCHEMBL6345576

Cc1cc(N(C(=O)[C@H]2CCCN2)C(=O)[C@H]2CCCN2)c2cncc(-c3ccc(Cl)cc3Cl)c2n1

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 17/20 0.41
SCN4A P35499 1/20 0.36
CCR4 P51679 2/20 0.36

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
SCHEMBL6345575 1.00 CRHR1 (0.41) CRHR1SCN4ACCR4
SCHEMBL7707751 0.71 CRHR1 (0.73) CRHR1
SCHEMBL6340859 0.70 CRHR1 (0.56) CRHR1
SCHEMBL7501629 0.60 SCN4A (0.58) SCN4A
SCHEMBL6726554 0.60 CRHR1 (1.00) CRHR1
SCHEMBL15747657 0.58 CCNC (0.49)
SCHEMBL5246749 0.58 CRHR1 (1.00) CRHR1
SCHEMBL5250469 0.58 CRHR1 (0.77) CRHR1
SCHEMBL29640018 0.58 ROCK2 (0.59)
SCHEMBL6722252 0.58 CRHR1 (1.00) CRHR1

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-6974808-B2 CRF receptor antagonists and methods relating thereto BRISTOL-MYERS SQUIBB COMPANY (US) 2005-12-13 US disclosed
US-20020049207-A1 CRF receptor antagonists and methods relating thereto BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-04-25 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-20020049207-A1 CRF receptor antagonists and methods relating thereto CRHR1, CRH, CRHR2 CRHR1 1/4885SCN4A 2532/4885CCR4 507/4885

“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.