SCHEMBL28064295

SCHEMBL28064295

O=C(Cc1cncs1)ON1CCC(CCOc2ccc(F)cc2)CC1CCOc1ccc(F)cc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 4/20 0.36
HCRTR2 O43614 4/20 0.36
LTA4H P09960 1/20 0.36
PARP15 Q460N3 1/20 0.34
PARP10 Q53GL7 1/20 0.34
MEN1 O00255 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FFAR1 O14842 1/20 0.33

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
SCHEMBL28064086 0.86 LTA4H (0.39) HCRTR1HCRTR2LTA4HPARP15PARP10
SCHEMBL28827929 0.83 ALDH1A1 (0.39) HCRTR1HCRTR2LTA4HMEN1POLB
SCHEMBL27884632 0.80 PARP15 (0.39) HCRTR1HCRTR2LTA4HPARP15PARP10
SCHEMBL28064060 0.77 LTA4H (0.39) LTA4HPARP15PARP10MEN1KMT2A
SCHEMBL28064084 0.76 TEAD1 (0.47) LTA4HPARP15PARP10
SCHEMBL28064087 0.75 TEAD1 (0.44) LTA4HPARP15PARP10
SCHEMBL28064068 0.75 PARP10 (0.53) LTA4HPARP15PARP10
SCHEMBL2227860 0.75 GRIN2B (0.47) LTA4HPARP15PARP10MEN1POLB
SCHEMBL28064070 0.75 LTA4H (0.39) LTA4HPARP15PARP10
SCHEMBL28088153 0.73 HRH3 (0.37) HCRTR1HCRTR2MEN1KMT2AKDM4E

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
CN-102803258-B Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SAI NUOFEI (FR) 2016-04-20 CN disclosed