SCHEMBL23616319

SCHEMBL23616319

CCC(=O)N(O)CC1CC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.56
ALDH1A1 P00352 1/20 0.38
PKM P14618 1/20 0.38
KDM5A P29375 1/20 0.33
KDM7A Q6ZMT4 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PLG P00747 1/20 0.31
PLAT P00750 1/20 0.31
LMNA P02545 1/20 0.31
MLYCD O95822 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
SCHEMBL15998881 0.77 ALOX5 (0.40) ALOX5ALDH1A1PKMKDM5AKDM7A
SCHEMBL25096917 0.72 ALOX5 (0.36) ALOX5ALDH1A1PKMMAPTSMN1; SMN2
SCHEMBL12846061 0.72 ALDH1A1 (0.57) ALDH1A1PKMMAPTSMN1; SMN2NPSR1
SCHEMBL23613015 0.70 ALOX5 (0.34) ALOX5ALDH1A1PKMMLYCD
SCHEMBL20280354 0.70 ALDH1A1 (0.40) ALOX5ALDH1A1PKMMAPTSMN1; SMN2
SCHEMBL11892779 0.70 ALOX5 (0.44) ALOX5ALDH1A1PKMKDM5AKDM4C
SCHEMBL8970759 0.69
SCHEMBL18611270 0.69 ALOX5 (0.33) ALOX5ALDH1A1PKM
SCHEMBL16054265 0.68 ALOX5 (0.47) ALOX5ALDH1A1PKM
SCHEMBL14321939 0.68 ALOX5 (0.46) ALOX5ALDH1A1KDM5AKDM4CPHF8

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
EP-2970154-B1 TETRAHYDROXAMATE CHELATORS OF ZIRCONIUM89 AND NIOBIUM90 FOR USE IN DIAGNOSTIC APPLICATIONS US HEALTH (US) 2021-07-07 EP disclosed