SCHEMBL8540926

SCHEMBL8540926

Cn1c2ccccc2c2ccc(C(O)c3cn(C(c4ccccc4)(c4ccccc4)c4ccccc4)cn3)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.40
KDM4E B2RXH2 3/20 0.37
HPGD P15428 3/20 0.37
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPT P10636 2/20 0.35
LMNA P02545 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
GPR3 P46089 1/20 0.35
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
TSHR P16473 1/20 0.33
SIRT2 Q8IXJ6 5/20 0.32
ATM Q13315 1/20 0.32
ENPP2 Q13822 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
GAA P10253 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL8541589 0.86 ACSS2 (0.39) KDM4EHPGDALDH1A1HSD17B10MAPT
SCHEMBL8540330 0.81 PSEN1 (0.48) GAA
SCHEMBL21636129 0.79 SIRT2 (0.35) SIRT2ENPP2ACSS2
SCHEMBL8545171 0.79 RECQL (0.40) ALDH1A1MAPTLMNASIRT2
SCHEMBL2202154 0.78 CYP11B1 (0.40) KDM4EALDH1A1LMNASIRT2ENPP2
SCHEMBL8541131 0.77
SCHEMBL8538922 0.77 PSEN1 (0.44) GAAHTT
SCHEMBL5688715 0.75 SIRT2 (0.40) NPC1RAB9ASIRT2ENPP2
SCHEMBL8540731 0.75 KIF11 (0.46) KIF11KDM4EHPGDALDH1A1HSD17B10
SCHEMBL5682208 0.75 AKR1C3 (0.40) LMNANPC1RAB9ATSHRSIRT2

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
EP-0820989-A1 IMIDAZOLE DERIVATIVES AND MEDICINAL COMPOSITION THEREOF YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1998-01-28 EP disclosed