SCHEMBL7119012

SCHEMBL7119012

CCCCC1CNCC(=O)N1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
GLB1 P16278 1/20 0.35
PRKCA P17252 3/20 0.33
TP53 P04637 1/20 0.33
HTT P42858 2/20 0.32
LMNA P02545 1/20 0.32
HLCS P50747 2/20 0.32
HSD17B10 Q99714 1/20 0.32
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL24087171 0.93 ALDH1A1 (0.50) ALDH1A1L3MBTL1MEN1KMT2APRKCA
SCHEMBL21945863 0.93 ALDH1A1 (0.50) ALDH1A1L3MBTL1MEN1KMT2APRKCA
SCHEMBL5062434 0.80
SCHEMBL21187321 0.76 NAAA (0.39) ALDH1A1L3MBTL1MEN1KMT2AHTT
SCHEMBL6036879 0.73 MAPT (0.45) ALDH1A1L3MBTL1MEN1KMT2AKDM4E
SCHEMBL6439316 0.73 ALDH1A1 (0.44) ALDH1A1L3MBTL1MEN1KMT2AKDM4E
SCHEMBL21193070 0.72
SCHEMBL203043 0.72
SCHEMBL21516050 0.72 MEN1 (0.31) MEN1KMT2ALMNA
SCHEMBL3833618 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030109559-A1 N-(3-amino-2-hydroxy-propyl)substituted alkylamide compounds PHARMACIA & UPJOHN COMPANY 2003-06-12 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-20030109559-A1 N-(3-amino-2-hydroxy-propyl)substituted alkylamide compounds BACE1, APP, BACE2 ALDH1A1 1479/4885L3MBTL1 2535/4885MEN1 1788/4885

“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.