SCHEMBL8545006

SCHEMBL8545006

CCn1c2ccccc2c2ccc(Cc3c[nH]cn3)cc21

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.42
MAPT P10636 5/20 0.42
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPK1 P28482 2/20 0.42
HPGD P15428 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HTT P42858 1/20 0.42
HBB P68871 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 3/20 0.41
POLB P06746 1/20 0.41
PDE10A Q9Y233 1/20 0.40
TP53 P04637 5/20 0.39
PTGER4 P35408 3/20 0.39
THRB P10828 1/20 0.39
NPY5R Q15761 5/20 0.39

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
SCHEMBL15625970 0.81 MAPT (0.56) KDM1AMAPTKDM4EALDH1A1MAPK1
SCHEMBL19762195 0.77 KDM4E (0.54) KDM1AMAPTKDM4EALDH1A1MAPK1
SCHEMBL15305703 0.77 KDM4E (0.61) MAPTKDM4EALDH1A1MAPK1HPGD
SCHEMBL15964261 0.75 KDM4E (0.56) MAPTKDM4EALDH1A1MAPK1HPGD
SCHEMBL14154595 0.75 MAPT (0.56) KDM1AMAPTKDM4EALDH1A1MAPK1
SCHEMBL8541232 0.74 PSEN1 (0.52) HTTPOLB
SCHEMBL27275931 0.73 CYP19A1 (0.56) KDM1AMAPTKDM4EALDH1A1MAPK1
SCHEMBL14113373 0.73 MAPT (0.50) KDM1AMAPTKDM4EALDH1A1MAPK1
SCHEMBL5574408 0.72 KIF11 (0.53) KDM4EALDH1A1HSD17B10
SCHEMBL15964268 0.72 KDM4E (0.56) MAPTKDM4EALDH1A1MAPK1HPGD

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