SCHEMBL6799775

SCHEMBL6799775

COC(=O)c1c(NC2CCOC2)cc(C)nc1Oc1c(OC)cc(Cl)cc1OC

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 2/20 0.38
PDE1B Q01064 8/20 0.37
PDCD1 Q15116 2/20 0.35
CD274 Q9NZQ7 2/20 0.35
EZH2 Q15910 1/20 0.34
PDE1C Q14123 5/20 0.33
PDE1A P54750 3/20 0.33
HPGDS O60760 1/20 0.33
FGFR1 P11362 2/20 0.33
FGFR2 P21802 2/20 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
SCHEMBL6797534 0.91 PDE1B (0.36) LRRK2PDE1BEZH2PDE1CPDE1A
SCHEMBL5844055 0.91 PDE1B (0.36) LRRK2PDE1BEZH2PDE1CPDE1A
SCHEMBL5845474 0.85 HPGDS (0.38) PDE1BPDE1CPDE1AHPGDS
SCHEMBL6800033 0.82 GRM5 (0.38) PDE1BHPGDS
SCHEMBL6792201 0.81 HSP90AA1 (0.41) PDE1BPDE1CPDE1A
SCHEMBL6799142 0.80 LRRK2 (0.36) LRRK2PDE1BEZH2
SCHEMBL6799139 0.80 LRRK2 (0.36) LRRK2PDE1BEZH2
SCHEMBL6797091 0.80 MCHR1 (0.35) PDE1BPDE1CPDE1AHPGDS
SCHEMBL6795536 0.80 PDE1B (0.37) PDE1BPDE1CPDE1AHPGDS
SCHEMBL6797756 0.79 HPGDS (0.35) LRRK2PDE1BHPGDS

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 LRRK2 1455/4885PDE1B 2331/4885PDCD1 4550/4885

“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.