SCHEMBL24717022

SCHEMBL24717022

CC1COCC(=O)N1c1ccc(F)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 6/20 0.41
HDAC8 Q9BY41 6/20 0.41
HDAC6 Q9UBN7 6/20 0.41
HDAC5 Q9UQL6 4/20 0.41
BPTF Q12830 1/20 0.39
TSHR P16473 1/20 0.39
RAD51 Q06609 1/20 0.36
NOTUM Q6P988 1/20 0.35
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
POLQ O75417 1/20 0.34
CYP11B2 P19099 1/20 0.33
ADAMTS5 Q9UNA0 2/20 0.32
CCR1 P32246 1/20 0.32
CCR2 P41597 1/20 0.32

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
SCHEMBL24717007 0.82 HDAC1 (0.43) HDAC1HDAC8HDAC6HDAC5BPTF
SCHEMBL29348974 0.77 MEN1 (0.38) TSHRNOTUMCCR1CCR2
SCHEMBL9892990 0.77 ABL1 (0.44) HDAC1HDAC8HDAC6HDAC5BPTF
SCHEMBL24415608 0.75 SLC6A2 (0.41) BPTFTSHRSLC6A2SLC6A4SLC6A3
SCHEMBL22854290 0.75 ALDH1A1 (0.39) HDAC1HDAC8HDAC6HDAC5NOTUM
SCHEMBL17689121 0.72 HDAC6 (0.40) HDAC1HDAC8HDAC6HDAC5NOTUM
SCHEMBL15713541 0.71 HDAC6 (0.39) HDAC1HDAC8HDAC6HDAC5
SCHEMBL17688867 0.70 HDAC6 (0.40) HDAC1HDAC8HDAC6HDAC5NOTUM
SCHEMBL21522934 0.69 NOTUM (0.32) NOTUM
SCHEMBL30888993 0.69 NOTUM (0.32) NOTUM

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-2022257894-A1 P300 INHIBITOR AND PHARMACEUTICAL USE THEREOF 贝达药业股份有限公司 2022-12-15 WO disclosed