SCHEMBL24822355

SCHEMBL24822355

COC(=O)Cc1cccc2cccnc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.49
ALDH1A1 P00352 4/20 0.48
LMNA P02545 3/20 0.48
MAPT P10636 4/20 0.47
HPGD P15428 3/20 0.47
HTT P42858 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TSHR P16473 1/20 0.47
PTBP1 P26599 1/20 0.47
TP53 P04637 2/20 0.47
KDM4E B2RXH2 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
POLB P06746 1/20 0.47
ADORA2A P29274 1/20 0.46
ADORA1 P30542 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
L3MBTL1 Q9Y468 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
SCHEMBL21807121 0.85 ALDH1A1 (0.61) HDAC6ALDH1A1LMNAMAPTHPGD
SCHEMBL19036261 0.83 HDAC6 (0.50) HDAC6ALDH1A1LMNAMAPTHPGD
SCHEMBL12899533 0.82 PARP1 (0.51) HDAC6ALDH1A1LMNAMAPTHPGD
SCHEMBL11807621 0.80 HDAC6 (0.43) HDAC6ALDH1A1LMNAMAPTHPGD
SCHEMBL30553881 0.80 KDM4E (0.59) HDAC6ALDH1A1LMNAMAPTHPGD
SCHEMBL3711541 0.80 KDM4E (0.59) HDAC6ALDH1A1LMNAMAPTHPGD
SCHEMBL13739599 0.80 PARP1 (0.49) ALDH1A1LMNAMAPTHPGDTP53
SCHEMBL22028701 0.79 KDM4E (0.41) ALDH1A1LMNAMAPTKMT2AKDM4E
SCHEMBL14678422 0.79 P2RX7 (0.47) ALDH1A1LMNAMAPTKMT2AKDM4E
SCHEMBL9268906 0.79 HDAC6 (0.49) HDAC6ALDH1A1LMNAMAPTHPGD

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-2022268066-A1 PROTEIN DEGRADATION AGENT 苏州开拓药业股份有限公司 2022-12-29 WO disclosed