SCHEMBL8265066

SCHEMBL8265066

Nc1ncccc1NCc1cc(-c2ccc3cc[nH]c3c2)ccc1OCc1ccccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 5/20 1.00
▸ PIK3CA P42336 3/20 0.45
▸ NOS3 P29474 1/20 0.42
▸ NOS1 P29475 1/20 0.42
▸ NOS2 P35228 1/20 0.42
▸ APP P05067 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ SYK P43405 5/20 0.37
▸ TNK2 Q07912 1/20 0.36
▸ PIK3CD O00329 1/20 0.36
▸ PIK3CB P42338 1/20 0.36
▸ PIK3CG P48736 1/20 0.36
▸ SLC6A4 P31645 1/20 0.35
▸ CCR5 P51681 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ ERBB2 P04626 1/20 0.35
▸ ERBB3 P21860 1/20 0.35
▸ ERBB4 Q15303 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
SCHEMBL8264955 0.90 BACE1 (1.00) BACE1TNK2CCR5
SCHEMBL8265056 0.87 BACE1 (0.88) BACE1NOS3NOS1NOS2TNK2
SCHEMBL8265032 0.86 BACE1 (0.85) BACE1PIK3CANOS3NOS1NOS2
SCHEMBL8264482 0.84 BACE1 (0.73) BACE1PIK3CATNK2PIK3CDPIK3CB
SCHEMBL8265368 0.82 BACE1 (0.71) BACE1PIK3CANOS3NOS1NOS2
SCHEMBL8264480 0.80 BACE1 (0.66) BACE1NOS3NOS1NOS2SYK
SCHEMBL4939573 0.79 BACE1 (0.65) BACE1PIK3CANOS3NOS1NOS2
SCHEMBL14007503 0.78 BACE1 (0.64) BACE1MAPTSYKCCR5
SCHEMBL8265251 0.76 BACE1 (1.00) BACE1PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL29941423 0.76 BACE1 (1.00) BACE1PIK3CAPIK3CDPIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287399-A1 Substituted Aminopyridines and Uses Thereof ASTRAZENECA AB (SE) 2008-11-20 — — US disclosed
US-20080287399-A1 Substituted Aminopyridines and Uses Thereof ASTRAZENECA AB (SE) 2008-11-20 — — US disclosed
WO-2006065204-A1 SUBSTITUTED AMINOPYRIDINES AND USES THEREOF ASTRAZENECA AB (SE) 2006-06-22 — — 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-20080287399-A1 Substituted Aminopyridines and Uses Thereof PSEN2, SLC1A2, PSEN1 BACE1 30/4885PIK3CA 3779/4885NOS3 318/4885

“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.

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