SCHEMBL24864797

SCHEMBL24864797

Cn1c(=O)c(C(=O)c2cc3ccccc3s2)c(O)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
KDM4E B2RXH2 4/20 0.50
MEN1 O00255 8/20 0.49
KMT2A Q03164 8/20 0.49
PGR P06401 1/20 0.49
CNR1 P21554 1/20 0.49
CNR2 P34972 1/20 0.49
NPC1 O15118 6/20 0.48
RAB9A P51151 6/20 0.48
NLRP3 Q96P20 2/20 0.47
LMNA P02545 2/20 0.47
TP53 P04637 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
DYRK1A Q13627 1/20 0.46
GAA P10253 2/20 0.46
USP2 O75604 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
PPARG P37231 1/20 0.46

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
SCHEMBL24864803 0.78 ALDH1A1 (0.62) ALDH1A1KDM4EMEN1KMT2APGR
SCHEMBL30804578 0.76 ALDH1A1 (0.72) ALDH1A1KDM4EMEN1KMT2APGR
SCHEMBL24864976 0.76 ALDH1A1 (0.72) ALDH1A1KDM4EMEN1KMT2APGR
SCHEMBL2886378 0.74 CNR1 (0.47) ALDH1A1KDM4ECNR1CNR2LMNA
Water SCHEMBL30804585 0.74 ALDH1A1 (0.68) ALDH1A1KDM4EMEN1KMT2APGR
SCHEMBL24864789 0.74 ALDH1A1 (0.56) ALDH1A1KDM4EMEN1KMT2APGR
SCHEMBL2281039 0.73 ALDH1A1 (1.00) ALDH1A1KDM4EMEN1KMT2APGR
SCHEMBL1685948 0.73 ALDH1A1 (0.77) ALDH1A1KDM4EMEN1KMT2APGR
SCHEMBL24864756 0.73 CA12 (0.53) ALDH1A1KDM4EMEN1KMT2ACNR1
SCHEMBL27752417 0.72 CNR1 (0.47) ALDH1A1KDM4EMEN1KMT2ACNR1

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-2023282236-A1 RARE EARTH COMPLEX 東ソー株式会社 2023-01-12 WO disclosed