SCHEMBL6043850

SCHEMBL6043850

COC1CCN(CCc2ccccc2C(=O)O)CC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.53
HTR4 Q13639 1/20 0.53
LMNA P02545 1/20 0.52
SCN1A P35498 2/20 0.50
SCN2A Q99250 2/20 0.50
SCN3A Q9NY46 2/20 0.50
SIGMAR1 Q99720 2/20 0.44
ALDH1A1 P00352 1/20 0.44
FOLH1 Q04609 1/20 0.44
KCNH2 Q12809 2/20 0.43
HRH1 P35367 1/20 0.43
CCR3 P51677 1/20 0.43
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
POLB P06746 1/20 0.43
GAA P10253 1/20 0.43
HRH3 Q9Y5N1 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
SCHEMBL6043465 0.85 SCN1A (0.49) LMNASCN1ASCN2ASCN3ASIGMAR1
SCHEMBL4021697 0.77 BCHE (0.65) HTR2ALMNAKCNH2HRH1HRH3
SCHEMBL6043362 0.77 SIGMAR1 (0.49) HTR2AHTR4SIGMAR1FOLH1KCNH2
SCHEMBL4021849 0.77 BCHE (0.65) SCN1ASCN2ASCN3ASIGMAR1CCR3
SCHEMBL6043506 0.76 ALDH1A1 (0.55) LMNASIGMAR1ALDH1A1FOLH1POLB
SCHEMBL11226725 0.74 SIGMAR1 (0.66) HTR2ALMNASIGMAR1ALDH1A1KCNH2
SCHEMBL6828683 0.73 HRH1 (0.50) ALDH1A1KCNH2HRH1CCR3GAA
SCHEMBL4500671 0.72 DRD2 (0.67) HTR2ALMNAKCNH2HRH1HRH3
SCHEMBL27596897 0.72 SIGMAR1 (0.64) HTR2ASIGMAR1KCNH2CCR3HRH3
SCHEMBL27983622 0.71 SCN1A (0.53) HTR2AHTR4SCN1ASCN2ASCN3A

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 5 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
CN-1136556-A Aromatic group substituted W-amino alkyl amide and alkyl amide CIBA GEIGY CO LTD (CH) 1996-11-27 CN 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 HTR2A 1481/4885HTR4 2022/4885LMNA 1636/4885

“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.