SCHEMBL6043465

SCHEMBL6043465

CCOC(=O)c1ccccc1CCN1CCC(OC)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 2/20 0.49
SCN2A Q99250 2/20 0.49
SCN3A Q9NY46 2/20 0.49
TSHR P16473 2/20 0.47
LMNA P02545 1/20 0.46
ALDH1A1 P00352 5/20 0.44
BRD4 O60885 1/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
POLB P06746 1/20 0.43
KDM4E B2RXH2 2/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HPGD P15428 1/20 0.41
SIGMAR1 Q99720 1/20 0.41

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
SCHEMBL6043850 0.85 HTR2A (0.53) SCN1ASCN2ASCN3ALMNAALDH1A1
SCHEMBL6042714 0.81 ALDH1A1 (0.55) TSHRALDH1A1KMT2AMEN1POLB
SCHEMBL6044228 0.81 ALDH1A1 (0.49) TSHRALDH1A1BRD4KMT2AMEN1
SCHEMBL8733285 0.73 TSHR (0.69) SCN1ASCN2ASCN3ATSHRLMNA
SCHEMBL21958104 0.72 TSHR (0.62) SCN1ASCN2ASCN3ATSHRLMNA
SCHEMBL578128 0.71 TSHR (0.77) TSHRLMNAALDH1A1KMT2AMEN1
SCHEMBL27463909 0.71 TSHR (0.61) SCN1ASCN2ASCN3ATSHRLMNA
SCHEMBL4500671 0.71 DRD2 (0.67) LMNAKMT2AMEN1
SCHEMBL23183168 0.70 TSHR (0.65) SCN1ASCN2ASCN3ATSHRLMNA
SCHEMBL1791133 0.70 TSHR (0.65) SCN1ASCN2ASCN3ATSHRLMNA

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-20060089355-A1 Methods of treating alzheimer's disease using aromatically substituted w-amino-alkanoic acid amides and alkanoic acid diamides ELAN PHARMACEUTICALS, INC. 2006-04-27 US disclosed
WO-2003103652-A1 METHODS OF TREATING ALZHEIMER’S DISEASE USING AROMATICALLY SUBSTITUTED ω-AMINO-ALKANOIC ACID AMIDES AND ALKANOIC ACID DIAMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed
US-5641778-A EXHIBIT RENIN-INHIBITING PROPERTIES AND CAN BE USED AS ANTIHYPERTENSIVE AGENTS CIBA-GEIGY CORPORATION (US) 1997-06-24 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-20060089355-A1 Methods of treating alzheimer's disease using aromatically substituted w-amino-alkanoic acid amides and alkanoic acid diamides APP, BACE1, BACE2 SCN1A 901/4885SCN2A 1488/4885SCN3A 1115/4885

“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.