SCHEMBL8446905

SCHEMBL8446905

COc1ccc(-c2ccc(-c3ccccc3)n2CC=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.49
MAPT P10636 6/20 0.49
KDM4E B2RXH2 6/20 0.49
POLB P06746 3/20 0.49
ALOX15 P16050 2/20 0.49
HSD17B10 Q99714 2/20 0.49
BACE1 P56817 3/20 0.48
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
LMNA P02545 3/20 0.45
HPGD P15428 3/20 0.45
NPSR1 Q6W5P4 3/20 0.45
GAA P10253 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
USP2 O75604 1/20 0.45
ALOX12 P18054 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
GLA P06280 2/20 0.44
GRIK1 P39086 1/20 0.43

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
SCHEMBL14035628 0.80 GRIK2 (0.59) ALDH1A1MAPTKDM4EPOLBALOX15
SCHEMBL14035629 0.79 MMP3 (0.47) ALDH1A1MAPTKDM4EHSD17B10BACE1
SCHEMBL8446811 0.79 NPC1 (0.48) BACE1HPGDGAANPC1RAB9A
SCHEMBL4483861 0.78 BACE1 (0.61) ALDH1A1MAPTKDM4EPOLBALOX15
SCHEMBL27783800 0.77 GRIK1 (0.71) ALDH1A1KDM4EPOLBHPGDNPSR1
SCHEMBL4472383 0.76 KDM4E (0.61) ALDH1A1MAPTKDM4EPOLBALOX15
SCHEMBL9152375 0.71 CA4 (0.68) ALDH1A1KDM4EBACE1LMNANPSR1
SCHEMBL291776 0.71 CA4 (0.68) ALDH1A1KDM4EBACE1LMNANPSR1
SCHEMBL17283658 0.71 CA4 (0.68) ALDH1A1KDM4EBACE1LMNANPSR1
Biphenyl SCHEMBL11784329 0.71 CA4 (0.68) ALDH1A1KDM4EBACE1LMNANPSR1

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-7488832-B2 e.g. N-[amino(imino)methyl]-2-[2-(4-phenoxyphenyl)-5-phenyl-1H-pyrrol-1-yl]acetamide; beta -amyloid deposits and neurofibrillary tangles; cognition activator, neurodegenerative diseases; Alzheimer's disease, Down's syndrome WYETH (US) 2009-02-10 US disclosed
US-20060183790-A1 Azolylacylguanidines as beta-secretase inhibitors WYETH (US) 2006-08-17 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-20060183790-A1 Azolylacylguanidines as beta-secretase inhibitors BACE1, BACE2, APP ALDH1A1 360/4885MAPT 30/4885KDM4E 1462/4885

“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.