SCHEMBL3260975

SCHEMBL3260975

Cc1cc(-n2ccc(-c3nccs3)n2)c(CCCO[Si](C)(C)C(C)(C)C)c(Cl)n1

nearest known ligand 0.44

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 19/20 0.44
PDE10A Q9Y233 1/20 0.34

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
SCHEMBL5309171 0.96 CRHR1 (0.44) CRHR1PDE10A
SCHEMBL3247778 0.83 CRHR1 (0.47) CRHR1PDE10A
SCHEMBL5252287 0.82 CRHR1 (0.47) CRHR1PDE10A
SCHEMBL5549998 0.82 CRHR1 (0.47) CRHR1PDE10A
Hydrochloric Acid SCHEMBL6283880 0.81 CRHR1 (0.47) CRHR1PDE10A
SCHEMBL3238577 0.80 CRHR1 (0.48) CRHR1PDE10A
SCHEMBL3244507 0.80 CRHR1 (0.45) CRHR1PDE10A
SCHEMBL3241949 0.80 CRHR1 (0.49) CRHR1
SCHEMBL5568398 0.79 GRM5 (0.34) CRHR1PDE10A
SCHEMBL3244939 0.78 CRHR1 (0.47) CRHR1PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1695974-B1 1,8-Naphthyridines as CRF antagonists GLAXO GROUP LTD (GB) 2010-03-17 EP disclosed
US-20070219232-A1 Chemical Compounds GLAXO GROUP LIMITED 2007-09-20 US disclosed
US-7253284-B2 Chemical compounds GIAXO GROUP LIMITED (GB) 2007-08-07 US disclosed
EP-1695974-A1 1,8-Naphthyridines as CRF antagonists GLAXO GROUP LIMITED (GB) 2006-08-30 EP disclosed
US-20040171607-A1 Chemical compounds GLAXO GROUP LIMITED (GB) 2004-09-02 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 (2 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-20040171607-A1 Chemical compounds CBR3, CBR1, CYP2B6 CRHR1 52/4885PDE10A 3086/4885
US-20070219232-A1 Chemical Compounds CBR3, CBR1, HCAR3 CRHR1 30/4885PDE10A 2690/4885

“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.