SCHEMBL6845282

SCHEMBL6845282

Bc1ccc2oc3cccnc3c(=O)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAOA P21397 3/20 0.40
MAPT P10636 5/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
HPGD P15428 2/20 0.38
GLA P06280 1/20 0.38
CYP3A4 P08684 1/20 0.38
PGAM1 P18669 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
NCOA1 Q15788 1/20 0.38
NPC1 O15118 7/20 0.38
RAB9A P51151 5/20 0.38
GFER P55789 1/20 0.38
TTR P02766 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36

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
SCHEMBL15889096 0.87 NPC1 (0.40) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL653724 0.82 RAB9A (0.62) KDM4EALDH1A1MEN1KMT2AMAOA
SCHEMBL570295 0.82 KMT2A (0.47) KDM4EALDH1A1MEN1KMT2AMAOA
SCHEMBL30641650 0.80 KDM4E (0.64) KDM4EALDH1A1MEN1KMT2AMAOA
SCHEMBL30593474 0.80 KDM4E (0.64) KDM4EALDH1A1MEN1KMT2AMAOA
SCHEMBL654368 0.80 KDM4E (0.64) KDM4EALDH1A1MEN1KMT2AMAOA
SCHEMBL14076685 0.78 CA12 (0.41) KDM4EALDH1A1MEN1KMT2AMAOA
SCHEMBL2763220 0.78 PON1 (0.44) KDM4EALDH1A1MEN1KMT2AMAOA
SCHEMBL652026 0.77 MAPT (0.51) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL14684135 0.77 MAOA (0.67) KDM4EALDH1A1MEN1KMT2AMAOA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011115938-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA - SECRETASE MODULATORS AMGEN INC. (US) 2011-09-22 WO disclosed
WO-2010030954-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETASECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2010-03-18 WO disclosed