SCHEMBL6793471

SCHEMBL6793471

CCC(CC)Nc1cc(C)nc(Oc2c(C)cc(Br)cc2C)c1C#N

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 3/20 0.59
LMNA P02545 1/20 0.41
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL5844580 0.91 CRHR1 (0.72) CRHR1
SCHEMBL6797859 0.88 CRHR1 (0.58) CRHR1LMNACYP1A2CYP2C19SMN1; SMN2
SCHEMBL6804572 0.87 CRHR1 (0.57) CRHR1LMNACYP1A2CYP2C19SMN1; SMN2
SCHEMBL5844051 0.84 CRHR1 (0.81) CRHR1
SCHEMBL5843834 0.84 CRHR1 (0.57) CRHR1
SCHEMBL6798181 0.83 CRHR1 (0.52) CRHR1LMNACYP1A2CYP2C19SMN1; SMN2
SCHEMBL6391536 0.82 CRHR1 (0.62) CRHR1
SCHEMBL5844058 0.82 CRHR1 (0.62) CRHR1
SCHEMBL6799763 0.82 CRHR1 (0.51) CRHR1
SCHEMBL6799682 0.82 CRHR1 (0.51) CRHR1CYP1A2CYP2C19SMN1; SMN2

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 8 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
EP-1263732-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS Pfizer Products Inc. (US) 2002-12-11 EP claimed
US-20020016328-A1 Corticotropin releasing factor antagonists PFIZER INC. 2002-02-07 US claimed
WO-2001053263-A1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2001-07-26 WO 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 CRHR1 3/4885LMNA 4189/4885CYP1A2 2264/4885

“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.