SCHEMBL15548600

SCHEMBL15548600

[Ho]n1nnc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 9/20 0.56
MAPT P10636 2/20 0.56
POLB P06746 1/20 0.56
MAPK1 P28482 1/20 0.56
ATM Q13315 1/20 0.56
KEAP1 Q14145 1/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
THPO P40225 1/20 0.56
CYP4Z1 Q86W10 1/20 0.56
DGAT1 O75907 1/20 0.50
GRM2 Q14416 1/20 0.47
RAB9A P51151 2/20 0.46
KCNMA1 Q12791 1/20 0.46
TSHR P16473 2/20 0.44
MGAM O43451 1/20 0.44
F2 P00734 1/20 0.44

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
SCHEMBL337232 0.76 SLC9A1 (0.56) SLC9A1MAPTPOLBMAPK1ATM
SCHEMBL3072391 0.75 SLC9A1 (0.60) SLC9A1MAPTPOLBMAPK1ATM
SCHEMBL9171873 0.74 SLC9A1 (0.54) SLC9A1MAPTPOLBMAPK1ATM
SCHEMBL247973 0.71 SLC9A1 (0.56) SLC9A1MAPTPOLBMAPK1ATM
SCHEMBL18372356 0.71 SLC9A1 (0.56) SLC9A1MAPTPOLBMAPK1ATM
SCHEMBL11872036 0.71 SLC9A1 (0.56) SLC9A1MAPTPOLBMAPK1ATM
SCHEMBL4634282 0.71 SLC9A1 (0.56) SLC9A1MAPTPOLBMAPK1ATM
SCHEMBL1012471 0.71 POLB (1.00) SLC9A1MAPTPOLBMAPK1ATM
SCHEMBL3672275 0.71 POLB (1.00) SLC9A1MAPTPOLBMAPK1ATM
SCHEMBL13602385 0.71 SLC9A1 (0.56) SLC9A1MAPTPOLBMAPK1ATM

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-2013177349-A2 QUINAZOLINEDIONES AS TANKYRASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2013-11-28 WO disclosed