SCHEMBL8545653

SCHEMBL8545653

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.44
HPGD P15428 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.42
KIF11 P52732 1/20 0.40
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
TSHR P16473 1/20 0.37
ROCK2 O75116 1/20 0.36
GLA P06280 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SRC P12931 2/20 0.36
EGFR P00533 1/20 0.36
CNR2 P34972 1/20 0.35
GPR3 P46089 1/20 0.35

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
SCHEMBL8542771 0.81 PSEN1 (0.52) HPGDALDH1A1HSD17B10
SCHEMBL8540560 0.78 PSEN1 (0.47) HPGDALDH1A1HSD17B10
SCHEMBL8539326 0.77 PDE10A (0.36) HSD17B10RXRARXRBTSHR
SCHEMBL5682164 0.77 CYP11B1 (0.43)
SCHEMBL1414929 0.77 SIRT2 (0.36) HPGDALDH1A1MAPTNPC1RAB9A
SCHEMBL5690739 0.75 SIRT2 (0.42) KDM4EHPGDALDH1A1MAPTNPC1
SCHEMBL4030987 0.75 MEN1 (0.51) MAPTNPC1RAB9ASMN1; SMN2CNR2
SCHEMBL8540731 0.75 KIF11 (0.46) KDM4EHPGDALDH1A1MAPTNPC1
SCHEMBL5678341 0.75 KDM4E (0.46) KDM4EHPGDALDH1A1HSD17B10TSHR
SCHEMBL4024355 0.75 SIRT2 (0.41) MAPTNPC1RAB9ASMN1; SMN2ACSS2

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