SCHEMBL3428156

SCHEMBL3428156

C1=Nc2cc(-c3ccc4c(c3)OCO4)nc(Nc3ccc(N4CCOCC4)cc3)c2CN1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 3/20 0.45
SYK P43405 5/20 0.43
BTK Q06187 3/20 0.43
MAPT P10636 4/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
USP2 O75604 1/20 0.41
FLT3 P36888 2/20 0.41
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
PIK3CA P42336 1/20 0.40
MTOR P42345 1/20 0.40
PIK3CG P48736 1/20 0.40
JAK2 O60674 3/20 0.40

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
SCHEMBL3405873 0.85 ZAP70 (0.46) ZAP70SYKBTKMAPTFLT3
SCHEMBL3402080 0.76 ZAP70 (0.48) ZAP70MAPTMEN1ALDH1A1TSHR
SCHEMBL3401682 0.76 ZAP70 (0.44) ZAP70MAPTMEN1ALDH1A1TSHR
SCHEMBL3397387 0.76 ZAP70 (0.48) ZAP70SYKMAPTMEN1TSHR
SCHEMBL3397301 0.76 MAPT (0.50) ZAP70SYKMAPTNPC1RAB9A
SCHEMBL1056532 0.75 SYK (0.65) ZAP70SYKBTKUSP2PIK3CA
SCHEMBL3428992 0.75 AURKA (0.49) ZAP70SYKMAPTBRD4MAPK1
SCHEMBL3362020 0.72 ZAP70 (0.46) ZAP70SYKBTKMAPTFLT3
SCHEMBL3406123 0.72 IGF1R (0.48) ZAP70MAPTMEN1ALDH1A1KMT2A
SCHEMBL12128810 0.70 MAPT (0.62) MAPTNPC1RAB9AMEN1ALDH1A1

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
EP-2250169-A1 PYRIDO [4, 3-D]PYRIMIDINONE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2010-11-17 EP claimed
WO-2009099801-A1 PYRIDO [4, 3-D] PYRIMIDINONE DERIVATIVES AS KINASE INHIBITORS IRM LLC (BM) 2009-08-13 WO claimed