SCHEMBL31033427

SCHEMBL31033427

CC(C)(C)OC(=O)N1CC(CCc2ccccc2Br)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.50
KDM1A O60341 1/20 0.43
NR1H2 P55055 1/20 0.43
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
RORC P51449 3/20 0.42
GPR119 Q8TDV5 1/20 0.41
USP30 Q70CQ3 2/20 0.39
KCNK3 O14649 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
PRMT5 O14744 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
ACKR3 P25106 1/20 0.38
TACR1 P25103 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38

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
SCHEMBL31033426 1.00 NAMPT (0.50) NAMPTKDM1ANR1H2KDM4EPKM
SCHEMBL28341502 0.82 NAMPT (0.54) NAMPTNR1H2KDM4EPKMRORC
SCHEMBL21723072 0.82 MGLL (0.51) NAMPTNR1H2RORCGPR119USP30
SCHEMBL15684511 0.81 KDM4E (0.51) NAMPTKDM1AKDM4EPKMGPR119
SCHEMBL25471652 0.80 PRMT5 (0.47) NAMPTKDM1ANR1H2KDM4EPKM
SCHEMBL18497375 0.77 GPR119 (0.49) NAMPTNR1H2KDM4EPKMGPR119
SCHEMBL27158359 0.75 ACKR3 (0.50) NAMPTKDM1AKDM4EPKMUSP30
SCHEMBL15845815 0.75 KDM4E (0.51) KDM1AKDM4EPKMGPR119
SCHEMBL23802337 0.75 GPR119 (0.48) NAMPTNR1H2KDM4EPKMGPR119
SCHEMBL23830741 0.75 NAMPT (0.53) NAMPTNR1H2KDM4EPKMRORC

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-2024175905-A1 DIMER COMPOUNDS Kesmalea Therapeutics Limited (GB) 2024-08-29 WO disclosed