SCHEMBL6796427

SCHEMBL6796427

CCC(CC)Nc1cc(C)nc(Oc2ccc(Cl)cc2OC(F)(F)F)c1C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
CRHR1 P34998 2/20 0.38
ALPL P05186 1/20 0.38
CNR2 P34972 1/20 0.35
MAP2 P11137 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
AKT1 P31749 2/20 0.33
ANO1 Q5XXA6 2/20 0.33
CD38 P28907 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
SCHEMBL6803947 0.91 CRHR1 (0.38) GAAHPGDCRHR1ALPLCNR2
SCHEMBL6793487 0.90 ALPL (0.38) CRHR1ALPLCNR2SLC6A2SLC6A4
SCHEMBL6798867 0.89 GAA (0.50) GAAHPGDCRHR1SLC6A2SLC6A4
SCHEMBL6793488 0.84 ALPL (0.39) GAAHPGDCRHR1ALPLCNR2
SCHEMBL6796886 0.80 GAA (0.41) GAAHPGDCRHR1SLC6A2SLC6A4
SCHEMBL6792226 0.80 RXFP1 (0.41) GAAHPGDCRHR1SLC6A2SLC6A4
SCHEMBL6798731 0.78 SLC6A2 (0.45) GAAHPGDCRHR1SLC6A2SLC6A4
SCHEMBL6794710 0.78 S1PR4 (0.40) GAAHPGDCRHR1SLC6A2SLC6A4
SCHEMBL6797556 0.77 CRHR1 (0.40) GAAHPGDCRHR1
SCHEMBL6792180 0.76 CRHR1 (0.41) GAAHPGDCRHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6833378-B2 Pyridines, pyrimidines, purinones, pyrrolopyrimidinones and pyrrolopyridinones; useful in the treatment disorders including CNS and stress-related disorders. PFIZER INC 2004-12-21 US claimed
US-20020016328-A1 Corticotropin releasing factor antagonists PFIZER INC. 2002-02-07 US claimed
US-6833378-B2 Pyridines, pyrimidines, purinones, pyrrolopyrimidinones and pyrrolopyridinones; useful in the treatment disorders including CNS and stress-related disorders. PFIZER INC 2004-12-21 US disclosed
EP-1263732-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS Pfizer Products Inc. (US) 2002-12-11 EP disclosed
US-20020016328-A1 Corticotropin releasing factor antagonists PFIZER INC. 2002-02-07 US disclosed
WO-2001053263-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2001-07-26 WO 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-20020016328-A1 Corticotropin releasing factor antagonists CRH, CRHR2, CRHR1 GAA 2029/4885HPGD 3224/4885CRHR1 3/4885

“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.