SCHEMBL26470796

SCHEMBL26470796

COC(=O)N[C@H]1CCc2c(C)c(F)cc(NC(C)=O)c2C1=O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
HDAC1 Q13547 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
ATM Q13315 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
PDE10A Q9Y233 1/20 0.31
HTR1A P08908 1/20 0.30
DRD2 P14416 1/20 0.30
HTR2A P28223 1/20 0.30
NPC1 O15118 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL22200884 0.91 LMNA (0.41) KDM4ELMNAPOLBMAPTHDAC1
SCHEMBL20783225 0.91 LMNA (0.41) KDM4ELMNAPOLBMAPTHDAC1
SCHEMBL26470798 0.90 RECQL (0.35) KDM4ELMNAPOLBMAPTPDE10A
SCHEMBL26471057 0.89 KDM4E (0.34) KDM4ELMNAPOLBMAPTHDAC1
SCHEMBL26470320 0.86 CYP11B2 (0.42) KDM4ELMNAPOLBMAPT
SCHEMBL26470794 0.86 KDM4E (0.33) KDM4ELMNAPOLBMAPTHDAC1
SCHEMBL26471064 0.83 KDM4E (0.36) KDM4ELMNAPOLBMAPTPDE10A
SCHEMBL26623065 0.82 HDAC1 (0.36) KDM4ELMNAHDAC1HDAC6CA1
SCHEMBL26623089 0.81 HDAC1 (0.35) KDM4ELMNAMAPTHDAC1HDAC6
SCHEMBL31689030 0.81 LMNA (0.46) KDM4ELMNAPOLBMAPTATM

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-2023072143-A1 CAMPTOTHECIN DERIVATIVE INTERMEDIATE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海弼领生物技术有限公司 2023-05-04 WO disclosed