SCHEMBL28566342

SCHEMBL28566342

Fc1cnn2cc(Br)cnc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.39
PRKAB2 O43741 1/20 0.37
PRKAG1 P54619 1/20 0.37
PRKAA2 P54646 1/20 0.37
PRKAA1 Q13131 1/20 0.37
PRKAG3 Q9UGI9 1/20 0.37
PRKAG2 Q9UGJ0 1/20 0.37
PRKAB1 Q9Y478 1/20 0.37
KDR P35968 4/20 0.34
FLT1 P17948 2/20 0.34
FLT4 P35916 2/20 0.34
PLK4 O00444 1/20 0.34
AURKA O14965 1/20 0.34
DYRK3 O43781 1/20 0.34
MAP4K4 O95819 1/20 0.34
NTRK1 P04629 1/20 0.34
INSR P06213 1/20 0.34
CDK1 P06493 1/20 0.34
FGFR1 P11362 1/20 0.34
CDK2 P24941 1/20 0.34

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
SCHEMBL3754835 0.79 PRKAB2 (0.54) MAOBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL31487914 0.76 MAPT (0.38) MAOBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL3772458 0.76 PRKAB2 (0.37) MAOBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL13960990 0.76 KDR (0.37) MAOBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL15333581 0.72 POLB (0.43) MAOBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL1991834 0.72 CDK2 (0.53) MAOBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL19265949 0.72 PRKAB2 (0.37) MAOBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL30749069 0.72 PLK4 (0.35) MAOBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL18397071 0.72 MAPT (0.35) MAOBPRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL16461023 0.71 MAP4K4 (0.39) MAP4K4SMN1; SMN2

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
CN-112574211-B Heterocyclic kinase inhibitors 山东轩竹医药科技有限公司 2022-06-14 CN disclosed
CN-112574211-A Heterocyclic kinase inhibitors 山东轩竹医药科技有限公司 2021-03-30 CN disclosed