SCHEMBL4423211

SCHEMBL4423211

CCCN1C(=O)CN=C(c2cccc(C(N)=O)c2)c2c1cc(OC)c(-c1ccccc1)c2OC.COc1cc2c(c(OC)c1-c1ccccc1)C(c1cccc(C(N)=O)c1)=NCC(=O)N2CC1CC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.54
PDE4D Q08499 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
FYN P06241 1/20 0.35
PTGDR2 Q9Y5Y4 5/20 0.34
FAAH O00519 5/20 0.33
DRD2 P14416 5/20 0.33
DRD3 P35462 5/20 0.33
PADI4 Q9UM07 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
OPRK1 P41145 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
SCHEMBL4414065 0.95 PDE2A (0.56) PDE2APDE4DTP53MAPTFYN
SCHEMBL4412620 0.94 PDE2A (0.60) PDE2APDE4DTP53MAPTFYN
SCHEMBL4602359 0.91 PDE2A (0.58) PDE2APDE4DTP53MAPTFYN
SCHEMBL4424399 0.87 PDE2A (0.60) PDE2APDE4DTP53MAPTFYN
SCHEMBL4414019 0.84 PDE2A (0.57) PDE2APDE4DTP53MAPTPTGDR2
SCHEMBL4411561 0.84 PDE2A (0.58) PDE2ATP53MAPTFYNPTGDR2
SCHEMBL4412658 0.83 PDE2A (0.72) PDE2APDE4DFYNFAAHDRD2
SCHEMBL4410766 0.81 GABRA1 (0.42) PDE2APDE4DTP53MAPTPTGDR2
SCHEMBL4707980 0.80 PDE2A (0.67) PDE2APDE4DTP53MAPTFYN
SCHEMBL4410915 0.79 GABRA1 (0.46) PDE2APDE4DTP53MAPTPTGDR2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090215752-A1 Compounds, preparation and therapeutic use thereof BAY CITY CAPITAL LLC 2009-08-27 US claimed

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-20090215752-A1 Compounds, preparation and therapeutic use thereof PDE12, PDE4B, PDE2A PDE2A 3/4885PDE4D 13/4885TP53 4884/4885

“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.