SCHEMBL3042364

SCHEMBL3042364

COc1cc2c(N3CCC(c4cc(F)cc(F)c4)CC3)nncc2c(OC)c1OC

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 6/20 0.36
GRM2 Q14416 2/20 0.36
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.34
NEK2 P51955 3/20 0.34
TGFBR1 P36897 1/20 0.34
ACVR1 Q04771 1/20 0.34
KCNH2 Q12809 1/20 0.34
PLK1 P53350 1/20 0.34
NEK1 Q96PY6 1/20 0.34
NTSR1 P30989 2/20 0.34
SLC2A1 P11166 1/20 0.33
SLC2A3 P11169 1/20 0.33
ACHE P22303 1/20 0.32
BACE1 P56817 1/20 0.32
MAOB P27338 1/20 0.32
ADORA2A P29274 1/20 0.32
MEN1 O00255 1/20 0.32
TTR P02766 1/20 0.32

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
SCHEMBL3049868 0.86 LMNA (0.42) PDE10AGRM2KMT2ALMNANEK2
SCHEMBL3051870 0.84 PDE10A (0.51) PDE10AKMT2ALMNANTSR1ACHE
SCHEMBL3062919 0.82 DRD2 (0.45) PDE10AGRM2KMT2ALMNA
SCHEMBL3057490 0.82 NTSR1 (0.45) PDE10AGRM2KMT2ALMNANTSR1
SCHEMBL3055190 0.81 NTSR1 (0.41) PDE10AKMT2ALMNANEK2PLK1
SCHEMBL3047040 0.81 PDE10A (0.39) PDE10AKMT2ALMNANEK2TGFBR1
SCHEMBL3056928 0.81 PDE10A (0.42) PDE10AKMT2ALMNANEK2NTSR1
SCHEMBL3062929 0.80 CHRM4 (0.43) PDE10AKMT2ALMNATGFBR1ACVR1
SCHEMBL3046932 0.80 LMNA (0.41) PDE10ALMNANEK2TGFBR1ACVR1
SCHEMBL3059442 0.79 STAT3 (0.44) KMT2AACHEBACE1MEN1

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 6/4885GRM2 1894/4885KMT2A 1399/4885

“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.