SCHEMBL8821045

SCHEMBL8821045

COc1cc2[nH]c3c(C)c4ccncc4c(C)c3c2cc1OC

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIT P10721 4/20 0.71
MEN1 O00255 4/20 0.71
KMT2A Q03164 4/20 0.71
RECQL P46063 3/20 0.71
MAPT P10636 3/20 0.71
KDM4E B2RXH2 3/20 0.71
NR3C1 P04150 2/20 0.71
POLB P06746 2/20 0.71
RAB9A P51151 2/20 0.71
NPSR1 Q6W5P4 2/20 0.71
TLR3 O15455 1/20 0.71
PKM P14618 1/20 0.71
PDGFRA P16234 1/20 0.63
FGFR3 P22607 1/20 0.63
ALDH1A1 P00352 3/20 0.61
TDP1 Q9NUW8 2/20 0.61
HPGD P15428 2/20 0.61
NPC1 O15118 1/20 0.61
GMNN O75496 1/20 0.61
LMNA P02545 1/20 0.61

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
SCHEMBL1005968 0.83 KIT (1.00) KITMEN1KMT2ARECQLMAPT
SCHEMBL17212473 0.80 KIT (0.76) KITMEN1KMT2ARECQLMAPT
SCHEMBL27170417 0.77 KIT (0.81) KITMEN1KMT2ARECQLMAPT
SCHEMBL27807938 0.77 KIT (1.00) KITMEN1KMT2ARECQLMAPT
SCHEMBL564035 0.77 KIT (1.00) KITMEN1KMT2ARECQLMAPT
SCHEMBL31060598 0.77 KIT (1.00) KITMEN1KMT2ARECQLMAPT
SCHEMBL31362096 0.77 KIT (1.00) KITMEN1KMT2ARECQLMAPT
SCHEMBL3342543 0.77 KIT (0.72) KITMEN1KMT2ARECQLMAPT
Hydrochloric Acid SCHEMBL15517783 0.76 KIT (0.97) KITMEN1KMT2ARECQLMAPT
Bromide SCHEMBL10413309 0.76 KIT (0.97) KITMEN1KMT2ARECQLMAPT

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
WO-1997046559-A1 PROCESS FOR PREPARING 9-HYDROXYELLIPTICINE TANABE SEIYAKU CO., LTD. (JP) 1997-12-11 WO disclosed