SCHEMBL6043570

SCHEMBL6043570

[CH2]CCCN1CCOC(C)C1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.44
DRD1 P21728 1/20 0.40
PDK1 Q15118 1/20 0.40
EBP Q15125 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
DRD3 P35462 4/20 0.33
SYK P43405 2/20 0.31
KEAP1 Q14145 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL27812343 0.89 KDM1A (0.47) KDM1ADRD1PDK1EBPSIGMAR1
SCHEMBL29645051 0.83 SIGMAR1 (0.52) KDM1ADRD1PDK1EBPSIGMAR1
SCHEMBL22463774 0.83 SIGMAR1 (0.52) KDM1ADRD1PDK1EBPSIGMAR1
SCHEMBL14027741 0.83 SIGMAR1 (0.52) KDM1ADRD1PDK1EBPSIGMAR1
SCHEMBL29307134 0.81 KDM1A (0.44) KDM1ADRD1PDK1EBPSIGMAR1
SCHEMBL22463763 0.81 EBP (0.59) KDM1ADRD1PDK1EBPSIGMAR1
SCHEMBL6043208 0.81 KDM1A (0.44) KDM1ADRD1PDK1EBPSIGMAR1
SCHEMBL9801679 0.81 KEAP1 (0.52) KDM1ADRD1PDK1EBPSIGMAR1
SCHEMBL4024791 0.81 KDM1A (0.44) KDM1ADRD1PDK1EBPSIGMAR1
SCHEMBL26621721 0.81 KDM1A (0.44) KDM1ADRD1PDK1EBPSIGMAR1

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-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
EP-0716077-A1 Aromatically substituted omega amino alcanoic acid amides and alcanoic diamides and their use as renine inhibitors CIBA-GEIGY AG (CH) 1996-06-12 EP 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 KDM1A 807/4885DRD1 906/4885PDK1 1907/4885

“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.