SCHEMBL3061987

SCHEMBL3061987

COc1cc2c(N3CCC(Cc4ccc(C)cc4)CC3)nncc2c(OC)c1OC

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.41
BACE1 P56817 2/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
NTSR1 P30989 1/20 0.40
KIT P10721 2/20 0.39
PDGFRB P09619 2/20 0.38
PDGFRA P16234 2/20 0.38
EHMT2 Q96KQ7 2/20 0.37
PDE5A O76074 1/20 0.36

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
SCHEMBL3059442 0.91 STAT3 (0.44) ACHEBACE1MEN1KMT2AKIT
SCHEMBL3059838 0.91 MEN1 (0.50) MEN1KMT2ALMNAMAPTNTSR1
SCHEMBL3055184 0.87 ENPP1 (0.39) MEN1KMT2ANTSR1KITPDGFRB
SCHEMBL3052142 0.85 PDE10A (0.46) ACHEBACE1MEN1KMT2ALMNA
SCHEMBL3059837 0.85 ENPP1 (0.36) MEN1KMT2ALMNANTSR1KIT
SCHEMBL3051124 0.82 NTSR1 (0.42) ACHEBACE1MEN1KMT2ALMNA
SCHEMBL3056812 0.82 EHMT2 (0.40) ACHEMEN1KMT2ALMNANTSR1
SCHEMBL3049176 0.80 ENPP1 (0.37)
SCHEMBL3053056 0.78 PDE10A (0.37) KMT2ALMNA
SCHEMBL3062460 0.77 PDE10A (0.47) ACHEBACE1

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-20100222353-A1 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS PFIZER PRODUCTS INC. (US) 2010-09-02 US claimed
US-20100222353-A1 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS PFIZER PRODUCTS INC. (US) 2010-09-02 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-20100222353-A1 AMINOPHTHALAZINE DERIVATIVE COMPOUNDS PDE12, PDE5A, PDE2A ACHE 24/4885BACE1 258/4885MEN1 3233/4885

“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.