SCHEMBL21216116

SCHEMBL21216116

CCN1CCCCC1CN(CCO)CC1CCCCN1C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.40
▸ KDM1A O60341 1/20 0.38
▸ PDE8B O95263 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.35
▸ HSD17B10 Q99714 1/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ HPGD P15428 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ CHEK2 O96017 1/20 0.33

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
SCHEMBL21216318 0.92 KDM1A (0.42) ATMKDM1APDE8BALDH1A1HSD17B10
SCHEMBL24335834 0.81 KDM1A (0.42) ATMKDM1APDE8BALDH1A1HSD17B10
SCHEMBL24335836 0.81 KDM1A (0.42) ATMKDM1APDE8BALDH1A1HSD17B10
SCHEMBL21216118 0.79 KDM1A (0.46) ATMKDM1AHSD17B10MEN1KMT2A
SCHEMBL18497645 0.78 ATM (0.44) ATMPDE8BALDH1A1HSD17B10MEN1
SCHEMBL18497643 0.78 ATM (0.44) ATMPDE8BALDH1A1HSD17B10MEN1
SCHEMBL190190 0.76 PDE8B (0.47) ATMKDM1APDE8BALDH1A1HSD17B10
SCHEMBL2345014 0.75 ATM (0.51) ATMKDM1APDE8BALDH1A1HSD17B10
SCHEMBL1551631 0.75 ATM (0.51) ATMKDM1APDE8BALDH1A1HSD17B10
SCHEMBL2354644 0.75 ATM (0.51) ATMKDM1APDE8BALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019145713-A9 OLIGONUCLEOTIDE AND NUCLEIC ACID SYNTHESIS EVONETIX LTD (GB) 2020-08-06 — — WO disclosed
WO-2019145713-A1 OLIGONUCLEOTIDE AND NUCLEIC ACID SYNTHESIS EVONETIX LTD (GB) 2019-08-01 — — WO disclosed
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