SCHEMBL6798514

SCHEMBL6798514

Cc1cc(NC2CCOC2)c(C=NO)c(Oc2c(C)cc(Cl)cc2C)n1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE1B Q01064 3/20 0.34
PDE1C Q14123 2/20 0.32
PDE1A P54750 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32
GPR6 P46095 6/20 0.31
EZH2 Q15910 1/20 0.31
MAT2A P31153 1/20 0.31
LRRK2 Q5S007 1/20 0.31
CRHR1 P34998 1/20 0.30
MAOB P27338 1/20 0.30
HTR6 P50406 1/20 0.30

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
SCHEMBL6798508 1.00 PDE1B (0.34) PDE1BPDE1CPDE1AADORA3ADORA2A
SCHEMBL6798085 0.84 CRHR1 (0.41) PDE1BPDE1CPDE1ACRHR1
SCHEMBL6799371 0.82 PDE1B (0.35) PDE1BPDE1CPDE1AADORA3ADORA2A
SCHEMBL6800968 0.82 EZH2 (0.35) PDE1BPDE1CPDE1AADORA3ADORA2A
SCHEMBL6792201 0.80 HSP90AA1 (0.41) PDE1BPDE1CPDE1A
SCHEMBL6797534 0.80 PDE1B (0.36) PDE1BPDE1CPDE1AEZH2LRRK2
SCHEMBL5844055 0.80 PDE1B (0.36) PDE1BPDE1CPDE1AEZH2LRRK2
SCHEMBL6798573 0.80 BCL6 (0.37) PDE1BPDE1CPDE1A
SCHEMBL6799142 0.79 LRRK2 (0.36) PDE1BADORA1EZH2LRRK2
SCHEMBL6799139 0.79 LRRK2 (0.36) PDE1BADORA1EZH2LRRK2

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 PDE1B 2331/4885PDE1C 3016/4885PDE1A 2369/4885

“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.