SCHEMBL5550003

SCHEMBL5550003

Cc1cc(-n2ccc(-c3nccs3)n2)c(CCO)c(Nc2ccc(C#N)cc2C(F)(F)F)n1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 19/20 0.49
SLC2A1 P11166 1/20 0.36
SLC2A3 P11169 1/20 0.36
SLC2A4 P14672 1/20 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
SCHEMBL5550638 0.90 CRHR1 (0.57) CRHR1SLC2A1SLC2A3SLC2A4
SCHEMBL5551914 0.89 CRHR1 (0.54) CRHR1
SCHEMBL5571989 0.89 CRHR1 (0.51) CRHR1SLC2A1SLC2A3SLC2A4
SCHEMBL5569003 0.88 CRHR1 (0.51) CRHR1SLC2A1SLC2A3SLC2A4
SCHEMBL5571467 0.87 CRHR1 (0.48) CRHR1
SCHEMBL3249256 0.86 CRHR1 (0.53) CRHR1
SCHEMBL5572320 0.85 CRHR1 (0.50) CRHR1
SCHEMBL5568075 0.82 CRHR1 (0.50) CRHR1
SCHEMBL5572074 0.82 CRHR1 (0.47) CRHR1
SCHEMBL5572490 0.81 CRHR1 (0.46) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 52/4885SLC2A1 2596/4885SLC2A3 2164/4885
US-20070219232-A1 Chemical Compounds CBR3, CBR1, HCAR3 CRHR1 30/4885SLC2A1 2954/4885SLC2A3 2503/4885

“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.