SCHEMBL4746799

SCHEMBL4746799

CCOC(=O)c1cnc2ccc(C(=O)N(Cl)CC)cc2c1Nc1ccc(C)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.67
SMN1; SMN2 Q16637 6/20 0.67
GAA P10253 5/20 0.67
TP53 P04637 4/20 0.67
PAX8 Q06710 1/20 0.65
LMNA P02545 3/20 0.59
HTT P42858 3/20 0.59
MC4R P32245 2/20 0.59
TDP1 Q9NUW8 2/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
MAPK1 P28482 1/20 0.59
CLK1 P49759 1/20 0.59
GSK3A P49840 1/20 0.59
GSK3B P49841 1/20 0.59
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
PTK2B Q14289 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
CREBBP Q92793 1/20 0.57
POLB P06746 1/20 0.56

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
SCHEMBL4750544 0.90 MAPT (0.68) MAPTSMN1; SMN2GAATP53PAX8
SCHEMBL5332873 0.86 PAX8 (0.85) MAPTSMN1; SMN2GAATP53PAX8
SCHEMBL4749735 0.86 PAX8 (0.81) MAPTSMN1; SMN2GAATP53PAX8
SCHEMBL3656790 0.84 PAX8 (0.69) MAPTSMN1; SMN2GAATP53PAX8
SCHEMBL4747116 0.83 PAX8 (0.67) MAPTSMN1; SMN2GAATP53PAX8
SCHEMBL4749024 0.83 PAX8 (0.67) MAPTSMN1; SMN2GAATP53PAX8
SCHEMBL4746796 0.82 PAX8 (0.64) MAPTSMN1; SMN2GAATP53PAX8
SCHEMBL4749734 0.81 PAX8 (0.67) MAPTSMN1; SMN2GAATP53PAX8
SCHEMBL4750019 0.81 PAX8 (0.65) MAPTSMN1; SMN2GAATP53PAX8
SCHEMBL4750541 0.81 PAX8 (0.65) MAPTSMN1; SMN2GAATP53PAX8

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-2008119771-A2 QUINOLINE-S-CARBOXYLIC ACID DERIVATIVES AS TYROSINE KINASE INHIBITORS CLANOTECH AB (SE) 2008-10-09 WO disclosed