SCHEMBL6800968

SCHEMBL6800968

CNCc1c(NC2CCOC2)cc(C)nc1Oc1c(C)cc(Cl)cc1C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 1/20 0.35
PDE1B Q01064 7/20 0.35
PDE1C Q14123 6/20 0.35
PDE1A P54750 4/20 0.35
CRHR1 P34998 1/20 0.34
PDCD1 Q15116 2/20 0.32
CD274 Q9NZQ7 2/20 0.32
CARM1 Q86X55 1/20 0.32
ADORA3 P0DMS8 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31

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
SCHEMBL6799371 0.89 PDE1B (0.35) EZH2PDE1BPDE1CPDE1ACRHR1
SCHEMBL6798085 0.86 CRHR1 (0.41) PDE1BPDE1CPDE1ACRHR1
SCHEMBL6798573 0.84 BCL6 (0.37) PDE1BPDE1CPDE1A
SCHEMBL6799142 0.82 LRRK2 (0.36) EZH2PDE1BADORA1
SCHEMBL6798508 0.82 PDE1B (0.34) EZH2PDE1BPDE1CPDE1ACRHR1
SCHEMBL6799139 0.82 LRRK2 (0.36) EZH2PDE1BADORA1
SCHEMBL6798514 0.82 PDE1B (0.34) EZH2PDE1BPDE1CPDE1ACRHR1
SCHEMBL6792201 0.80 HSP90AA1 (0.41) PDE1BPDE1CPDE1A
SCHEMBL6797534 0.80 PDE1B (0.36) EZH2PDE1BPDE1CPDE1A
SCHEMBL5844055 0.80 PDE1B (0.36) EZH2PDE1BPDE1CPDE1A

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-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 EZH2 1343/4885PDE1B 2331/4885PDE1C 3016/4885

“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.