SCHEMBL28625372

SCHEMBL28625372

OCc1cc(-c2cccc(Br)c2)on1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.68
CHEK1 O14757 1/20 0.49
AURKA O14965 1/20 0.49
DAPK3 O43293 1/20 0.49
JAK2 O60674 1/20 0.49
PRKD3 O94806 1/20 0.49
MAP4K4 O95819 1/20 0.49
LCK P06239 1/20 0.49
RET P07949 1/20 0.49
MET P08581 1/20 0.49
PDGFRB P09619 1/20 0.49
PIM1 P11309 1/20 0.49
FGFR1 P11362 1/20 0.49
PDGFRA P16234 1/20 0.49
PRKACA P17612 1/20 0.49
FLT1 P17948 1/20 0.49
LTK P29376 1/20 0.49
GRK5 P34947 1/20 0.49
KDR P35968 1/20 0.49
MAP2K2 P36507 1/20 0.49

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
SCHEMBL30337186 1.00 NOTUM (0.68) NOTUMCHEK1AURKADAPK3JAK2
SCHEMBL30336471 0.84 NOTUM (0.46) NOTUMRAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL28624057 0.84 NOTUM (0.46) NOTUMRAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL5502 0.81 NOTUM (0.70) NOTUMCHEK1AURKADAPK3JAK2
SCHEMBL9451412 0.81 NOTUM (0.68) NOTUMCHEK1AURKADAPK3JAK2
SCHEMBL1544128 0.81 NOTUM (1.00) NOTUMCHEK1AURKADAPK3JAK2
SCHEMBL1544808 0.81 NOTUM (0.69) NOTUMCHEK1AURKADAPK3JAK2
SCHEMBL8232026 0.81 NOTUM (0.68) NOTUMCHEK1AURKADAPK3JAK2
SCHEMBL2900829 0.81 NOTUM (0.68) NOTUMCHEK1AURKADAPK3JAK2
SCHEMBL4629123 0.81 NOTUM (0.68) NOTUMCHEK1AURKADAPK3JAK2

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-113307779-B Heterocyclic substituted biphenyl compound, preparation method and application 中国药科大学 2023-04-21 CN disclosed
CN-113307779-A Heterocyclic substituted biphenyl compound, preparation method and application 中国药科大学 2021-08-27 CN disclosed