SCHEMBL3056922

SCHEMBL3056922

COc1cc2c(N3CCC(C(O)c4cccnc4)CC3)nncc2c(OC)c1OC

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 5/20 0.37
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
GFER P55789 1/20 0.37
LMNA P02545 2/20 0.37
DGAT1 O75907 1/20 0.36
TP53 P04637 1/20 0.36
STAT3 P40763 1/20 0.35

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
SCHEMBL3051576 0.91 STAT3 (0.43) PDE10ACYP1A2LMNASTAT3
SCHEMBL3042948 0.87 PDE10A (0.47) PDE10APDE3BPDE3APDE4APDE4B
SCHEMBL3056098 0.83 PDE10A (0.38) PDE10APDE3BPDE3ALMNA
SCHEMBL3055267 0.80 MAPK1 (0.36) PDE10APDE3A
SCHEMBL3049868 0.77 LMNA (0.42) PDE10APDE3BPDE3ALMNATP53
SCHEMBL3059676 0.77 PDE10A (0.55) PDE10ALMNASTAT3
SCHEMBL3055190 0.75 NTSR1 (0.41) PDE10APDE3BPDE3ALMNA
SCHEMBL3052995 0.74 PDE10A (0.49) PDE10APDE3BPDE3ALMNA
SCHEMBL3052033 0.74 PDE10A (0.41) PDE10APDE3BPDE3ALMNA
SCHEMBL3053175 0.73 LMNA (0.44) PDE10APDE3BPDE3ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100222353-A1 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS PFIZER PRODUCTS INC. (US) 2010-09-02 US claimed
EP-1981868-A2 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS Pfizer Products Inc. (US) 2008-10-22 EP claimed
WO-2007085954-A2 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-08-02 WO claimed
US-20100222353-A1 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS PFIZER PRODUCTS INC. (US) 2010-09-02 US disclosed
EP-1981868-A2 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS Pfizer Products Inc. (US) 2008-10-22 EP disclosed
WO-2007085954-A2 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS PFIZER PRODUCTS INC. (US) 2007-08-02 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-20100222353-A1 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS PDE12, PDE5A, PDE2A PDE10A 6/4885PDE3B 9/4885PDE3A 5/4885

“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.