SCHEMBL23974808

SCHEMBL23974808

CCC(=O)On1nnc2cccnc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.49
MGLL Q99685 3/20 0.49
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 3/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.39
ALOX15 P16050 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
PABPC1 P11940 1/20 0.38
MAPK1 P28482 1/20 0.38
ATM Q13315 1/20 0.38
MAPT P10636 2/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC4 P56524 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
SCHEMBL12435588 0.88 FAAH (0.45) FAAHMGLLLMNAKDM4EALDH1A1
SCHEMBL2217546 0.85 FAAH (0.43) FAAHMGLLLMNAKDM4EALDH1A1
SCHEMBL2293707 0.85 FAAH (0.43) FAAHMGLLLMNAKDM4EALDH1A1
SCHEMBL2295830 0.85 FAAH (0.43) FAAHMGLLLMNAKDM4EALDH1A1
SCHEMBL9996736 0.85 FAAH (0.45) FAAHMGLLLMNAKDM4EALDH1A1
SCHEMBL7012103 0.84 FAAH (0.44) FAAHMGLLLMNAALDH1A1GAA
SCHEMBL12435616 0.84 HPSE (0.45) FAAHMGLLLMNAKDM4EALDH1A1
SCHEMBL2217398 0.84 HPSE (0.45) FAAHMGLLLMNAKDM4EALDH1A1
SCHEMBL20489265 0.84 HPSE (0.53) FAAHMGLLLMNAMEN1KMT2A
SCHEMBL20489267 0.84 HPSE (0.53) FAAHMGLLLMNAMEN1KMT2A

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-2021222767-A1 CD33 LIGANDS SUITABLE FOR INCORPORATION INTO CARRIERS GLYCOMIMETICS, INC. (US) 2021-11-04 WO disclosed