SCHEMBL16701653

SCHEMBL16701653

ClNc1cccc2[nH]ncc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.58
JAK1 P23458 1/20 0.58
NOS1 P29475 4/20 0.58
AXL P30530 2/20 0.53
NPC1 O15118 2/20 0.50
HTT P42858 2/20 0.50
RAB9A P51151 2/20 0.50
LMNA P02545 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
HPGD P15428 1/20 0.50
CYP2C19 P33261 1/20 0.50
IDO1 P14902 1/20 0.50
ALDH1A1 P00352 2/20 0.49
METAP2 P50579 1/20 0.49
CLK4 Q9HAZ1 1/20 0.48
DHPS P49366 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL16703680 0.81 JAK2 (0.58) JAK2JAK1NOS1AXLNPC1
SCHEMBL20239474 0.81 JAK2 (0.58) JAK2JAK1NOS1AXLNPC1
SCHEMBL18193501 0.81 JAK2 (0.58) JAK2JAK1NOS1AXLNPC1
SCHEMBL8306066 0.81 JAK2 (0.68) JAK2JAK1NOS1AXLNPC1
SCHEMBL23593790 0.77 JAK2 (0.54) JAK2JAK1NOS1AXLNPC1
SCHEMBL21600866 0.77 JAK2 (0.58) JAK2JAK1NOS1AXLNPC1
SCHEMBL11733937 0.77 JAK2 (0.54) JAK2JAK1NOS1AXLNPC1
SCHEMBL21964331 0.77 JAK2 (0.58) JAK2JAK1NOS1AXLNPC1
SCHEMBL17738849 0.77 KDM4E (0.55) JAK2JAK1NOS1AXLNPC1
SCHEMBL28163797 0.77 JAK2 (0.58) JAK2JAK1NOS1AXLNPC1

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-3066100-A1 (AZA)PYRIDOPYRAZOLOPYRIMIDINONES AND INDAZOLOPYRIMIDINONES AS INHIBITORS OF FIBRINOLYSIS Bayer Pharma Aktiengesellschaft (DE) 2016-09-14 EP disclosed
WO-2015067549-A1 (AZA)PYRIDOPYRAZOLOPYRIMIDINONES AND INDAZOLOPYRIMIDINONES AS INHIBITORS OF FIBRINOLYSIS BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-05-14 WO disclosed