SCHEMBL3674841

SCHEMBL3674841

CCOC(=O)Oc1cc2c(Cl)nc(-c3ccc(Cl)cc3Cl)cn2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
KDM4E B2RXH2 2/20 0.41
GSK3B P49841 3/20 0.40
DPP4 P27487 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
TSHR P16473 2/20 0.39
LMNA P02545 1/20 0.39
CNR1 P21554 1/20 0.38
GABRA2 P47869 5/20 0.37
GABRB2 P47870 5/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CDC7 O00311 1/20 0.37
DBF4 Q9UBU7 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
ALPL P05186 1/20 0.35

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
SCHEMBL1513972 0.83 GSK3B (0.52) MAPTKDM4EGSK3BDPP4DPP8
SCHEMBL3676712 0.80 KDM4E (0.44) MAPTKDM4EDPP4DPP8DPP9
SCHEMBL12762528 0.78 GSK3B (0.45) KDM4EGSK3BDPP4DPP8LMNA
SCHEMBL14237167 0.77 GSK3B (0.72) MAPTKDM4EGSK3BDPP4DPP8
SCHEMBL1110696 0.71 ALDH1A1 (0.46) MAPTKDM4ETSHRLMNACNR1
SCHEMBL167398 0.70 SIGMAR1 (0.52) MAPTKDM4ELMNACNR1GABRA2
SCHEMBL1514053 0.69 LMNA (0.47) MAPTKDM4EGSK3BLMNACNR1
SCHEMBL10584537 0.67 GABRA2 (0.45) MAPTKDM4ELMNACNR1GABRA2
SCHEMBL168942 0.67 SLC5A1 (0.48) MAPTKDM4ELMNACNR1GABRA2
SCHEMBL376669 0.67 KDM4E (0.45) MAPTKDM4ELMNACNR1GABRA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2176264-B1 IMIDAZO-, PYRAZOLOPYRAZINES AND IMIDAZOTRIAZINES FOR TREATING HEMATOLOGICAL DISORDERS BAYER IP GMBH (DE) 2012-12-19 EP disclosed
EP-2176264-A1 IMIDAZO-, PYRAZOLOPYRAZINES AND IMIDAZOTRIAZINES AND THEIR USE Bayer Schering Pharma AG (DE) 2010-04-21 EP disclosed
WO-2009007029-A1 IMIDAZO-, PYRAZOLOPYRAZINES AND IMIDAZOTRIAZINES AND THEIR USE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-01-15 WO disclosed