SCHEMBL29196317

SCHEMBL29196317

CONCc1ccc(F)nc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
DYRK1A Q13627 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTR1A P08908 3/20 0.34
HTR7 P34969 3/20 0.34
AURKA O14965 1/20 0.34
ABL1 P00519 1/20 0.34
NTRK1 P04629 1/20 0.34
LCK P06239 1/20 0.34
CSF1R P07333 1/20 0.34
RET P07949 1/20 0.34
MET P08581 1/20 0.34
PDGFRB P09619 1/20 0.34
PIM1 P11309 1/20 0.34
PDGFRA P16234 1/20 0.34
FLT3 P36888 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
SCHEMBL6348675 0.79 CYP11B1 (0.42) CYP11B1CYP11B2DYRK1ACLK4CYP3A4
SCHEMBL29196394 0.78 KDM1A (0.50) CYP2C19
SCHEMBL29196353 0.77 KDM1A (0.47) CYP3A4CYP2C19HTR1ALCKCSF1R
SCHEMBL10246359 0.76 LMNA (0.41) CYP11B1CYP11B2DYRK1ACLK4CYP3A4
SCHEMBL22912585 0.75 CYP11B1 (0.42) CYP11B1CYP11B2DYRK1AGRIN1GRIN2B
SCHEMBL13428822 0.74 CD274 (0.41) CYP11B1CYP11B2DYRK1ACLK4CYP3A4
SCHEMBL3971719 0.74 LMNA (0.52) CNR1
SCHEMBL29694478 0.72 P4HTM (0.51) CYP11B1CYP11B2DYRK1ACLK4CYP3A4
SCHEMBL29694479 0.72 P4HTM (0.51) CYP11B1CYP11B2DYRK1ACLK4CYP3A4
SCHEMBL28763189 0.72 P4HTM (0.51) CYP11B1CYP11B2DYRK1ACLK4CYP3A4

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
CN-117924277-A Oxime ether compound and preparation method, pharmaceutical composition and application thereof 中国药科大学 2024-04-26 CN disclosed