SCHEMBL28967461

SCHEMBL28967461

CCOP(OCC)c1c2cc(F)ccc2nn1-c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
KCNH2 Q12809 8/20 0.38
MAT2A P31153 1/20 0.36
KMT2A Q03164 2/20 0.34
GSR P00390 1/20 0.34
PIK3CA P42336 1/20 0.34
POLB P06746 1/20 0.34
MIF P14174 1/20 0.34
MPI P34949 1/20 0.34
MEN1 O00255 1/20 0.34
ATM Q13315 1/20 0.34
AKR1B10 O60218 1/20 0.34
P2RX7 Q99572 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33

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
SCHEMBL28967486 0.89 GAA (0.38) LMNAKMT2APIK3CAPOLBMEN1
SCHEMBL28967457 0.88 MPO (0.39) KMT2AMEN1
SCHEMBL28967459 0.84 MPO (0.42) LMNAMAT2A
SCHEMBL28967458 0.83 ESR2 (0.43) LMNAKMT2A
SCHEMBL28967453 0.80 PTGS1 (0.43) KMT2AMEN1ATM
SCHEMBL28967465 0.78 MAT2A (0.42) LMNAMAT2APOLB
SCHEMBL28967469 0.75 MPO (0.58) LMNAKMT2AMEN1
SCHEMBL28967479 0.74 TP53 (0.40) LMNAKMT2AMEN1
SCHEMBL28967475 0.73 MPO (0.39) LMNAATM
SCHEMBL28967467 0.71 MPO (0.51) ATM

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-115613060-A Method for synthesizing C-3 phosphorylated 2H-indazole compound by direct electrochemical oxidation 浙江工业大学 2023-01-17 CN disclosed