SCHEMBL6044015

SCHEMBL6044015

CN1CCN(C(=O)CC[O])CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.50
CYP1A2 P05177 1/20 0.50
KMT2A Q03164 3/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
KDM4E B2RXH2 1/20 0.48
USP2 O75604 1/20 0.48
LMNA P02545 1/20 0.48
CYP3A4 P08684 1/20 0.48
HSD17B10 Q99714 1/20 0.48
HTR1A P08908 1/20 0.45
ATM Q13315 1/20 0.43
GNAI3 P08754 2/20 0.42
GNAO1 P09471 2/20 0.42
GNAI1 P63096 2/20 0.42
MAPT P10636 1/20 0.42
PHGDH O43175 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
SCHEMBL6043354 0.87 ATM (0.50) TDP1CYP1A2KMT2AHTTSMN1; SMN2
SCHEMBL6043595 0.85 GNAI3 (0.50) TDP1CYP1A2KMT2AHTTSMN1; SMN2
SCHEMBL6044018 0.82 TDP1 (0.50) TDP1CYP1A2KMT2AHTTSMN1; SMN2
SCHEMBL805507 0.82 GNAI3 (0.50) TDP1CYP1A2KMT2AHTTSMN1; SMN2
SCHEMBL1385227 0.81 TDP1 (0.54) TDP1CYP1A2KMT2AHTTSMN1; SMN2
SCHEMBL19634475 0.81 ATM (0.48) TDP1CYP1A2KMT2AHTTSMN1; SMN2
SCHEMBL24854624 0.80 ATM (0.58) TDP1CYP1A2KMT2AHTTSMN1; SMN2
SCHEMBL1711871 0.80 TDP1 (0.48) TDP1CYP1A2KMT2AHTTSMN1; SMN2
SCHEMBL5842058 0.80 HTT (0.51) TDP1CYP1A2KMT2AHTTSMN1; SMN2
SCHEMBL14254866 0.80 TDP1 (0.54) TDP1CYP1A2KMT2AHTTSMN1; SMN2

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 TDP1 381/4885CYP1A2 1848/4885KMT2A 2309/4885

“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.