SCHEMBL6798573

SCHEMBL6798573

Cc1cc(NC2CCOC2)c(C#N)c(Oc2c(C)cc(Cl)cc2C)n1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCL6 P41182 1/20 0.37
PDE1B Q01064 6/20 0.35
PDE1C Q14123 4/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MAPK8 P45983 1/20 0.34
MAPK9 P45984 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
PDE1A P54750 2/20 0.34
LMNA P02545 2/20 0.33
CYP3A4 P08684 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
CYP2C9 P11712 1/20 0.33
KCNH2 Q12809 1/20 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
SCHEMBL6798085 0.86 CRHR1 (0.41) PDE1BPDE1CPDE1A
SCHEMBL6800968 0.84 EZH2 (0.35) PDE1BPDE1CPDE1A
SCHEMBL6799371 0.83 PDE1B (0.35) PDE1BPDE1CPDE1A
SCHEMBL5844055 0.80 PDE1B (0.36) PDE1BPDE1CPDE1A
SCHEMBL6792201 0.80 HSP90AA1 (0.41) PDE1BPDE1CPOLBPDE1ACYP2C9
SCHEMBL6797534 0.80 PDE1B (0.36) PDE1BPDE1CPDE1A
SCHEMBL6799142 0.80 LRRK2 (0.36) PDE1BMAPK1
SCHEMBL6799139 0.80 LRRK2 (0.36) PDE1BMAPK1
SCHEMBL6798514 0.80 PDE1B (0.34) PDE1BPDE1CPDE1A
SCHEMBL6798508 0.80 PDE1B (0.34) PDE1BPDE1CPDE1A

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 2 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
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 (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 BCL6 2848/4885PDE1B 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.