SCHEMBL4150692

SCHEMBL4150692

Cn1c(N)nc(Cc2cccc(C=Cc3ccncc3)c2)cc1=O

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 12/20 0.57
NPC1 O15118 2/20 0.44
MAPT P10636 2/20 0.44
GFER P55789 1/20 0.44
KDM1A O60341 1/20 0.36
GSK3B P49841 3/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL4150691 1.00 BACE1 (0.57) BACE1NPC1MAPTGFERKDM1A
SCHEMBL4152977 0.92 BACE1 (0.64) BACE1NPC1MAPTKDM4EALDH1A1
SCHEMBL4152976 0.92 BACE1 (0.64) BACE1NPC1MAPTKDM4EALDH1A1
SCHEMBL4155646 0.86 BACE1 (0.57) BACE1MAPTKDM4EALDH1A1LMNA
SCHEMBL4139418 0.86 BACE1 (0.57) BACE1NPC1MAPTALDH1A1RAB9A
SCHEMBL4155652 0.86 BACE1 (0.57) BACE1MAPTKDM4EALDH1A1LMNA
SCHEMBL4139412 0.86 BACE1 (0.57) BACE1NPC1MAPTALDH1A1RAB9A
SCHEMBL4142855 0.85 BACE1 (0.56) BACE1
SCHEMBL4142853 0.85 BACE1 (0.56) BACE1
SCHEMBL4136356 0.84 BACE1 (0.61) BACE1

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-20090221579-A1 Substituted Amino-Compounds and Uses Thereof ASTEX THERAPEUTICS (GB) 2009-09-03 US disclosed
US-20090062282-A1 Substituted Amino-Pyrimidones and Uses Thereof ASTRAZENECA AB (SE) 2009-03-05 US disclosed
EP-1802587-A1 SUBSTITUTED AMINO-COMPOUNDS AND USES THEREOF AstraZeneca AB (SE) 2007-07-04 EP disclosed
WO-2006041404-A1 SUBSTITUTED AMINO-COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2006-04-20 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 (2 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-20090221579-A1 Substituted Amino-Compounds and Uses Thereof APP, PSEN1, BACE1 BACE1 3/4885NPC1 1190/4885MAPT 5/4885
US-20090062282-A1 Substituted Amino-Pyrimidones and Uses Thereof APP, PSEN1, PSEN2 BACE1 4/4885NPC1 2655/4885MAPT 5/4885

“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.