SCHEMBL8891496

SCHEMBL8891496

OCCOc1ccc(Nc2nc(NC3CCCCC3)c3cc(Cl)ccc3n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 6/20 0.52
CAMK2D Q13557 3/20 0.51
AURKA O14965 1/20 0.48
DAPK3 O43293 1/20 0.48
JAK2 O60674 1/20 0.48
PRKD3 O94806 1/20 0.48
MAP4K4 O95819 1/20 0.48
PAK4 O96013 1/20 0.48
ABL1 P00519 1/20 0.48
NTRK1 P04629 1/20 0.48
LCK P06239 1/20 0.48
FYN P06241 1/20 0.48
CSF1R P07333 1/20 0.48
RET P07949 1/20 0.48
MET P08581 1/20 0.48
PDGFRB P09619 1/20 0.48
PIM1 P11309 1/20 0.48
FGFR1 P11362 1/20 0.48
PDGFRA P16234 1/20 0.48
PRKACA P17612 1/20 0.48

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
SCHEMBL8890736 0.84 CAMK2D (0.51) MERTKCAMK2DAURKADAPK3JAK2
SCHEMBL8889429 0.82 MERTK (0.69) MERTKADORA3NPY5RADORA2A
Hydrochloric Acid SCHEMBL8911047 0.81 MERTK (0.68) MERTKCAMK2DNPY5R
SCHEMBL27223391 0.81 CAMK2D (0.68) MERTKCAMK2DAURKADAPK3JAK2
SCHEMBL30896225 0.81 CAMK2D (0.68) MERTKCAMK2DAURKADAPK3JAK2
SCHEMBL30896236 0.79 MERTK (0.56) MERTKCAMK2DAURKADAPK3JAK2
SCHEMBL27223397 0.79 MERTK (0.56) MERTKCAMK2DAURKADAPK3JAK2
SCHEMBL30896198 0.76 MERTK (0.76) MERTKCAMK2DTP53ADORA3NPY5R
SCHEMBL8889650 0.76 MERTK (0.76) MERTKCAMK2DTP53ADORA3NPY5R
SCHEMBL27223364 0.75 MERTK (0.76) MERTKCAMK2DNPY5R

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997020822-A1 QUINAZOLIN-2,4-DIAZIRINES AS NPY RECEPTOR ANTAGONIST NOVARTIS AG (CH) 1997-06-12 WO claimed