SCHEMBL4699387

SCHEMBL4699387

COC(C)(C)CCn1nc(Nc2c(Cl)cccc2Cl)c2ccc(Nc3ccc(N4CCN(C(=O)O)CC4)cc3)cc21

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 14/20 0.56
LCK P06239 3/20 0.38
BTK Q06187 2/20 0.38
KDR P35968 1/20 0.38
JAK3 P52333 1/20 0.38
TEK Q02763 1/20 0.38
DGAT1 O75907 3/20 0.37
RORC P51449 1/20 0.37
WEE1 P30291 1/20 0.37

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
SCHEMBL30338396 0.94 TNK2 (0.56) TNK2LCKBTKKDRJAK3
SCHEMBL2958057 0.86 TNK2 (0.49) TNK2LCKBTKKDRJAK3
SCHEMBL2957631 0.74 TNK2 (0.62) TNK2LCKBTKKDRJAK3
SCHEMBL2959345 0.70 TNK2 (0.46) TNK2WEE1
SCHEMBL30338434 0.66 TNK2 (0.55) TNK2LCKBTKKDRJAK3
SCHEMBL2955423 0.65 TNK2 (0.76) TNK2LCKBTKKDRJAK3
SCHEMBL30338350 0.65 POLB (0.45) TNK2BTK
SCHEMBL13239773 0.63 TNK2 (0.81) TNK2LCKBTKKDRJAK3
SCHEMBL30338625 0.63 TNK2 (1.00) TNK2LCKBTKKDRJAK3
SCHEMBL30338295 0.62 TNK2 (0.42) TNK2BTK

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-1926734-A1 PYRAZOLOPYRIDINE AND PYRAZOLOPYRIMIDINE COMPOUNDS USEFUL AS KINASE ENZYMES MODULATORS Amgen Inc. (US) 2008-06-04 EP disclosed
WO-2007024680-A1 PYRAZOLOPYRIDINE AND PYRAZOLOPYRIMIDINE COMPOUNDS USEFUL AS KINASE ENZYMES MODULATORS AMGEN INC. (US) 2007-03-01 WO disclosed