SCHEMBL29618436

SCHEMBL29618436

CN1CCN(Cc2ccc(NC(=N)N)cn2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK7 Q13164 1/20 0.47
CLK2 P49760 1/20 0.46
CLK3 P49761 1/20 0.46
DYRK1A Q13627 1/20 0.46
AXL P30530 2/20 0.42
MERTK Q12866 2/20 0.42
PAICS P22234 1/20 0.41
MELK Q14680 3/20 0.39
LTA4H P09960 1/20 0.39
HIF1A Q16665 1/20 0.37
EPAS1 Q99814 1/20 0.37
LMNA P02545 1/20 0.37
RAB9A P51151 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
PDE7A Q13946 1/20 0.36
TP53 P04637 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
CA1 P00915 1/20 0.36

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
SCHEMBL23246028 1.00 MAPK7 (0.47) MAPK7CLK2CLK3DYRK1AAXL
SCHEMBL23245929 0.90 AXL (0.42) MAPK7CLK2CLK3DYRK1AAXL
SCHEMBL29618374 0.90 AXL (0.42) MAPK7CLK2CLK3DYRK1AAXL
SCHEMBL29618393 0.82 KCNH2 (0.39) MAPK7HIF1AEPAS1PDE7A
SCHEMBL23245950 0.82 KCNH2 (0.39) MAPK7HIF1AEPAS1PDE7A
SCHEMBL23245914 0.77 RAB9A (0.60) RAB9AL3MBTL1SMN1; SMN2PDE7A
Hydrochloric Acid SCHEMBL29618414 0.76 RAB9A (0.58) RAB9AL3MBTL1SMN1; SMN2PDE7A
Hydrochloric Acid SCHEMBL23245938 0.76 RAB9A (0.58) RAB9AL3MBTL1SMN1; SMN2PDE7A
SCHEMBL18713012 0.74 ALDH1A1 (0.45) MAPK7LTA4HLMNAHRH3
SCHEMBL1126227 0.74 LMNA (0.57) CLK2CLK3DYRK1APAICSLTA4H

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
CN-114502555-B Derivatives of 4- (imidazo [1,2-a ] pyridin-3-yl) -N- (pyridin-3-yl) pyrimidin-2-amine for the treatment of proliferative diseases and disorders 常州千红生化制药股份有限公司 2024-07-16 CN disclosed
EP-4045506-A1 DERIVATIVES OF 4-(IMIDAZO[1,2-A]PYRIDIN-3-YL)-N-(PYRIDIN-3-YL) PYRIMIDIN-2- AMINE FOR TREATING PROLIFERATIVE DISEASES AND CONDITIONS Aucentra Therapeutics Pty Ltd (AU) 2022-08-24 EP disclosed
CN-114502555-A Derivatives of 4- (imidazo [1,2-a ] pyridin-3-yl) -N- (pyridin-3-yl) pyrimidin-2-amines for the treatment of proliferative diseases and disorders 常州千红生化制药股份有限公司 2022-05-13 CN disclosed