SCHEMBL9243789

SCHEMBL9243789

CCCCCOc1ccc2cccnc2c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 3/20 0.52
KDM4E B2RXH2 7/20 0.47
RAB9A P51151 6/20 0.47
NPC1 O15118 5/20 0.47
HSP90AA1 P07900 2/20 0.47
PAX8 Q06710 2/20 0.47
MAPK1 P28482 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
MAPT P10636 4/20 0.46
LMNA P02545 3/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
GAA P10253 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 2/20 0.44
KDM4A O75164 1/20 0.44
KDM4C Q9H3R0 1/20 0.44
POLB P06746 1/20 0.44
PKM P14618 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL9568616 0.81 MAPT (0.66) MCHR1KDM4ERAB9ANPC1MAPK1
SCHEMBL10647335 0.80 MCHR1 (0.67) MCHR1KDM4ERAB9ANPC1MAPK1
SCHEMBL16114005 0.80 MCHR1 (0.67) MCHR1KDM4ERAB9ANPC1MAPK1
SCHEMBL18691791 0.80 MCHR1 (0.67) MCHR1KDM4ERAB9ANPC1MAPK1
SCHEMBL9632939 0.80 MCHR1 (0.67) MCHR1KDM4ERAB9ANPC1MAPK1
SCHEMBL1507898 0.78 HTT (0.55) KDM4ERAB9ANPC1HSP90AA1MAPK1
SCHEMBL10705017 0.78 TRPV1 (0.49) KDM4ERAB9ANPC1HSP90AA1PAX8
SCHEMBL11759262 0.77 TYR (0.49) KDM4ERAB9ANPC1HSP90AA1PAX8
SCHEMBL11757253 0.77 TYR (0.49) KDM4ERAB9ANPC1HSP90AA1PAX8
SCHEMBL8937738 0.77 TYR (0.49) KDM4ERAB9ANPC1HSP90AA1PAX8

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
US-5456988-A Having organic emitting layer including quinolinol derivative metal complex SANYO ELECTRIC CO., LTD. (JP) 1995-10-10 US disclosed