SCHEMBL5844815

SCHEMBL5844815

CCC(CC)Oc1cc(C)nc(Nc2c(C)cc(Cl)cc2C)c1C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CRHR1 P34998 1/20 0.40

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
SCHEMBL5844195 0.91 CRHR1 (0.49) CRHR1
SCHEMBL5845758 0.89 CRHR1 (0.40) CRHR1
SCHEMBL6797656 0.86 HPGD (0.47) ALDH1A1MAPK1SMN1; SMN2CRHR1
SCHEMBL5844550 0.82 CRHR1 (0.39) CRHR1
SCHEMBL5844403 0.82 HPGD (0.44) ALDH1A1MAPK1SMN1; SMN2
SCHEMBL5845333 0.81 CRHR1 (0.48) CRHR1
SCHEMBL27489799 0.81 CRHR1 (0.36) CRHR1
SCHEMBL5843964 0.79 CRHR1 (0.46) CRHR1
SCHEMBL6792213 0.79 CRHR1 (0.44) MAPK1SMN1; SMN2CRHR1
SCHEMBL5844170 0.78 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125880-B1 Corticotropin releasing factor antagonists PFIZER INC. (US) 2006-10-24 US disclosed
US-7067664-B1 Corticotropin releasing factor antagonists PFIZER INC. (US) 2006-06-27 US disclosed
US-6956047-B1 Corticotropin releasing factor antagonists PFIZER INC. (US) 2005-10-18 US disclosed
US-20050032846-A1 Corticotropin releasing factor antagonists PFIZER INC. 2005-02-10 US disclosed
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
CN-1395566-A Corticotropin releasing factor antagonists PFIZER PROD INC (US) 2003-02-05 CN disclosed
US-20020016328-A1 Corticotropin releasing factor antagonists PFIZER INC. 2002-02-07 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-20020016328-A1 Corticotropin releasing factor antagonists CRH, CRHR2, CRHR1 ALDH1A1 4505/4885MAPK1 1208/4885SMN1; SMN2 1860/4885
US-20050032846-A1 Corticotropin releasing factor antagonists CRH, CRHR2, CRHR1 ALDH1A1 4423/4885MAPK1 3258/4885SMN1; SMN2 731/4885

“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.