SCHEMBL21807447

SCHEMBL21807447

C=Cc1cccc2c1CN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 2/20 0.51
CRBN Q96SW2 2/20 0.51
MAPK1 P28482 1/20 0.47
NAMPT P43490 4/20 0.44
HDAC1 Q13547 1/20 0.43
ESR2 Q92731 1/20 0.42
ABHD6 Q9BV23 2/20 0.42
NR1H2 P55055 2/20 0.41
UCHL1 P09936 1/20 0.40
SCN9A Q15858 1/20 0.39
TGM2 P21980 2/20 0.38
F13A1 P00488 1/20 0.38
TGM1 P22735 1/20 0.38
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
LIPG Q9Y5X9 1/20 0.37

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
SCHEMBL31357860 0.89 ESR2 (0.51) DDB1CRBNMAPK1NAMPTESR2
SCHEMBL31357971 0.89 ESR2 (0.51) DDB1CRBNMAPK1NAMPTESR2
SCHEMBL15103354 0.88 DDB1 (0.52) DDB1CRBNMAPK1NAMPTHDAC1
SCHEMBL30156851 0.88 DDB1 (0.52) DDB1CRBNMAPK1NAMPTHDAC1
SCHEMBL14615809 0.85 ABHD6 (0.44) DDB1CRBNNAMPTABHD6TGM2
SCHEMBL24812773 0.85 DDB1 (0.49) DDB1CRBNMAPK1NAMPTHDAC1
SCHEMBL25601626 0.82 DDB1 (0.56) DDB1CRBNMAPK1NAMPTHDAC1
SCHEMBL15893734 0.81 DDB1 (0.55) DDB1CRBNMAPK1NAMPTHDAC1
SCHEMBL8221404 0.81 DDB1 (0.55) DDB1CRBNMAPK1NAMPTHDAC1
SCHEMBL1050056 0.80 DDB1 (0.41) DDB1CRBNMAPK1NAMPTABHD6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3852790-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X Forma Therapeutics, Inc. (US) 2021-07-28 EP disclosed
CN-113164571-A Inhibition of ubiquitin-specific peptidase 9X 福马治疗股份有限公司 2021-07-23 CN disclosed
WO-2020061261-A1 INHIBITING UBIQUITIN SPECIFIC PEPTIDASE 9X FORMA THERAPEUTICS, INC. (US) 2020-03-26 WO disclosed