SCHEMBL28113162

SCHEMBL28113162

O=C(O)c1cc2cc(Br)c(F)cc2o1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 11/20 0.56
CSNK2A1 P68400 4/20 0.51
CSNK2A2 P19784 3/20 0.51
CSNK2B P67870 3/20 0.51
CSNK2A3 Q8NEV1 3/20 0.51
PIM2 Q9P1W9 5/20 0.47
MCL1 Q07820 1/20 0.45
GPR35 Q9HC97 2/20 0.43
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
KDM4E B2RXH2 2/20 0.38
TSHR P16473 2/20 0.38
GLA P06280 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
USP2 O75604 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
SCHEMBL4310530 0.85 PIM1 (0.53) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL1701238 0.79 PIM1 (0.56) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL28644005 0.77 AKR1B1 (0.44) KDM4ETSHRMAPTHPGDHSD17B10
SCHEMBL11739995 0.77 PIM1 (0.57) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL22588087 0.76 PIM1 (0.51) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL6333731 0.76 AKR1B1 (0.53) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL22587735 0.72 PIM1 (0.44) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL20563607 0.72 PIM1 (0.56) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL29127652 0.72 PIM1 (0.54) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3
SCHEMBL9424948 0.72 PIM1 (0.55) PIM1CSNK2A1CSNK2A2CSNK2BCSNK2A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106478564-B Cathepsin K inhibitors and uses thereof 广东东阳光药业有限公司 2021-11-12 CN disclosed
CN-106478564-A Cathepsin K inhibitor and application thereof 广东东阳光药业有限公司 2017-03-08 CN disclosed