SCHEMBL6845283

SCHEMBL6845283

Bc1ccc(Oc2cccnc2C#N)cc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GCK P35557 1/20 0.41
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
CYP19A1 P11511 2/20 0.37
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
PLCG1 P19174 1/20 0.35
ERBB2 P04626 1/20 0.34
GRM2 Q14416 3/20 0.33
TLR8 Q9NR97 2/20 0.33
CYP11B1 P15538 2/20 0.33
SLC6A4 P31645 1/20 0.33
CYP11B2 P19099 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL6054468 0.85 ALDH1A1 (0.44) GCKPOLBGAACYP19A1ALDH1A1
SCHEMBL570633 0.84 KDM4E (0.42) GCKPOLBGAACYP19A1ALDH1A1
SCHEMBL20165747 0.84 MEN1 (0.51) GCKPOLBGAACYP19A1ALDH1A1
SCHEMBL28455691 0.80 AHR (0.39) GCKALOX5AP
SCHEMBL11458038 0.74 CYP19A1 (0.54) CYP19A1ALDH1A1SMN1; SMN2SLC6A4
SCHEMBL11476143 0.74 RAB9A (0.49) POLBGAACYP19A1ALDH1A1SMN1; SMN2
SCHEMBL8803364 0.74 SLC22A12 (0.45) CYP19A1ALDH1A1SMN1; SMN2ALOX5APFEN1
SCHEMBL11465936 0.72 LMNA (0.43) POLBALDH1A1SMN1; SMN2SLC6A4KDM4E
SCHEMBL22820313 0.72 PLCG1 (0.41) POLBALDH1A1SMN1; SMN2ALOX5APFEN1
SCHEMBL11459830 0.72 MAPT (0.50) GCKCYP19A1ALDH1A1SMN1; SMN2KDM4E

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