SCHEMBL9541698

SCHEMBL9541698

CCOC(=O)c1cnc2nc(C)c(OCC)cc2c1Nc1cc(C)c(OC)c(C)c1.CCOc1cc2c(Nc3cc(Cl)c(O)c(Cl)c3)ccnc2nc1C

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.43
THRB P10828 3/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 4/20 0.39
DYRK1A Q13627 1/20 0.39
POLB P06746 1/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL8568881 0.87 MAPT (0.47) MAPTTHRBGAATP53MEN1
SCHEMBL8566892 0.81 POLB (0.39) MAPTTHRBGAAPOLBMEN1
SCHEMBL8567114 0.80 MAPT (0.51) MAPTTHRBGAATP53MEN1
Hydrochloric Acid SCHEMBL8561018 0.80 POLB (0.38) MAPTTHRBGAAPOLBMEN1
SCHEMBL9541717 0.79 MAPT (0.50) MAPTTHRBGAASMN1; SMN2TP53
Hydrochloric Acid SCHEMBL9259992 0.78 MAPT (0.49) MAPTTHRBGAATP53MEN1
SCHEMBL8564456 0.77 MAPT (0.48) MAPTTHRBGAASMN1; SMN2TP53
Hydrochloric Acid SCHEMBL8559342 0.77 MAPT (0.47) MAPTTHRBGAASMN1; SMN2TP53
SCHEMBL8563378 0.76 PDE4B (0.59) MAPTTHRBGAASMN1; SMN2TP53
SCHEMBL8561272 0.76 GAK (0.37) MAPTTHRBGAASMN1; SMN2POLB

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-1993013097-A1 ANTI-RHEUMATIC NAPHTHYRIDINE DERIVATIVES THE BOOTS COMPANY PLC (GB) 1993-07-08 WO disclosed