SCHEMBL5468434

SCHEMBL5468434

COc1cc2ncnc(N3Cc4ccccc4C3)c2cc1OC

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 8/20 0.68
BACE1 P56817 8/20 0.68
EGFR P00533 3/20 0.64
CSF1R P07333 1/20 0.62
AURKA O14965 4/20 0.62
INSR P06213 1/20 0.62
IGF1R P08069 1/20 0.62
CDK4 P11802 1/20 0.62
AURKB Q96GD4 1/20 0.62
HTR7 P34969 1/20 0.62
PDE10A Q9Y233 2/20 0.61
KIT P10721 2/20 0.58
PDE3A Q14432 1/20 0.58

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
SCHEMBL14407961 0.91 HTR7 (0.68) ACHEBACE1EGFRCSF1RAURKA
SCHEMBL4399140 0.85 HTR7 (0.64) ACHEBACE1EGFRCSF1RAURKA
SCHEMBL25686067 0.84 ACHE (0.57) ACHEBACE1EGFRAURKAHTR7
SCHEMBL25686047 0.83 ACHE (0.53) ACHEBACE1EGFRCSF1RAURKA
SCHEMBL11882354 0.82 ACHE (0.88) ACHEBACE1AURKAPDE10A
SCHEMBL4119501 0.82 ACHE (0.59) ACHEBACE1EGFRCSF1RAURKA
SCHEMBL4761451 0.81 ACHE (0.67) ACHEBACE1EGFRCSF1RHTR7
SCHEMBL20771414 0.80 EGFR (0.57) ACHEBACE1EGFRCSF1RAURKA
SCHEMBL23721410 0.80 ACHE (0.75) ACHEBACE1EGFRAURKAHTR7
Hydrochloric Acid SCHEMBL4760523 0.80 ACHE (0.66) ACHEBACE1EGFRCSF1RHTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070093515-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-04-26 US claimed
US-20070093515-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-04-26 US disclosed
US-20070093515-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-04-26 US disclosed
US-20070093515-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-04-26 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-20070093515-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE12, PDE10A ACHE 66/4885BACE1 707/4885EGFR 4754/4885

“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.