SCHEMBL24335836

SCHEMBL24335836

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

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.42
▸ PDE8B O95263 1/20 0.41
▸ ATM Q13315 2/20 0.41
▸ HSD17B10 Q99714 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ OPRD1 P41143 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ AHCY P23526 1/20 0.36
▸ METTL3 Q86U44 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ EPHX1 P07099 1/20 0.36

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
SCHEMBL24335834 1.00 KDM1A (0.42) KDM1APDE8BATMHSD17B10HPGD
SCHEMBL21216318 0.88 KDM1A (0.42) KDM1APDE8BATMHSD17B10HPGD
SCHEMBL21216116 0.81 ATM (0.40) KDM1APDE8BATMHSD17B10HPGD
SCHEMBL2354644 0.81 ATM (0.51) KDM1APDE8BATMHSD17B10HPGD
SCHEMBL1551631 0.81 ATM (0.51) KDM1APDE8BATMHSD17B10HPGD
SCHEMBL2345014 0.81 ATM (0.51) KDM1APDE8BATMHSD17B10HPGD
SCHEMBL20522096 0.81 HSD17B10 (0.49) PDE8BATMHSD17B10HPGDOPRD1
SCHEMBL1401178 0.81 HSD17B10 (0.49) PDE8BATMHSD17B10HPGDOPRD1
SCHEMBL282976 0.81 POLB (0.51) KDM1APDE8BATMHSD17B10HPGD
SCHEMBL192841 0.81 POLB (0.51) KDM1APDE8BATMHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022064187-A1 COMPOUNDS AS MODULATORS OF ENDOPLASMIC RETICULUM AMINOPEPTIDASE 1 (ERAP1) Grey Wolf Therapeutics Limited (GB) 2022-03-31 — — WO disclosed
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