SCHEMBL3060696

SCHEMBL3060696

COc1ccc(OC2CCN(c3nncc4c(OC)c(OC)c(OC)cc34)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 2/20 0.44
ACVR1 Q04771 2/20 0.44
PDE3B Q13370 11/20 0.42
PDE3A Q14432 11/20 0.42
PDE10A Q9Y233 10/20 0.42
GPR6 P46095 4/20 0.42
NPSR1 Q6W5P4 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ACVR1B P36896 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL3062929 0.93 CHRM4 (0.43) TGFBR1ACVR1PDE3BPDE3APDE10A
SCHEMBL3053175 0.93 LMNA (0.44) TGFBR1ACVR1PDE3BPDE3APDE10A
SCHEMBL3049166 0.91 GPR6 (0.45) TGFBR1ACVR1PDE3BPDE3APDE10A
SCHEMBL3055217 0.88 PDE3B (0.44) TGFBR1ACVR1PDE3BPDE3APDE10A
SCHEMBL3052995 0.87 PDE10A (0.49) PDE3BPDE3APDE10ALMNAKMT2A
SCHEMBL3055244 0.87 PDE3B (0.41) TGFBR1ACVR1PDE3BPDE3APDE10A
SCHEMBL3062047 0.86 PDE3B (0.41) PDE3BPDE3APDE10AGPR6LMNA
SCHEMBL3057939 0.85 GPR6 (0.43) PDE3BPDE3APDE10AGPR6LMNA
SCHEMBL3062116 0.85 PDE10A (0.49) PDE3BPDE3APDE10AGPR6LMNA
SCHEMBL3052978 0.84 PDE10A (0.52) PDE3BPDE3APDE10ALMNAKMT2A

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 TGFBR1 3862/4885ACVR1 2128/4885PDE3B 9/4885

“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.