SCHEMBL5434836

SCHEMBL5434836

Cn1cc(-c2cc(Oc3cccc(NC(=O)c4ccc(Oc5ccccc5)cc4)c3)ccn2)cn1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 4/20 0.61
AURKA O14965 3/20 0.61
KDR P35968 6/20 0.56
AXL P30530 1/20 0.53
NR1H4 Q96RI1 1/20 0.53
CSF1R P07333 8/20 0.51
PDGFRB P09619 5/20 0.51
PDGFRA P16234 4/20 0.51
KIT P10721 4/20 0.51
MET P08581 3/20 0.51
FLT3 P36888 2/20 0.51
FLT1 P17948 1/20 0.49
GALK1 P51570 1/20 0.49
CASP6 P55212 1/20 0.49
MCL1 Q07820 1/20 0.49
PLEC Q15149 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
NPC1 O15118 1/20 0.49
TP53 P04637 1/20 0.49
RECQL P46063 1/20 0.49

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
SCHEMBL5432770 0.95 AURKB (0.55) AURKBAURKAKDRAXLNR1H4
SCHEMBL5441045 0.95 KDR (0.55) AURKBAURKAKDRAXLCSF1R
SCHEMBL5449992 0.92 AURKB (0.53) AURKBAURKAKDRAXLCSF1R
SCHEMBL5436679 0.92 KDR (0.53) AURKBAURKAKDRAXLCSF1R
SCHEMBL5436669 0.91 AURKA (0.52) AURKBAURKAKDRAXLCSF1R
SCHEMBL5449985 0.91 KDR (0.51) AURKBAURKAKDRAXLCSF1R
SCHEMBL5426079 0.90 MAPT (0.54) AURKBAURKAKDRAXLNR1H4
SCHEMBL5431660 0.90 THRB (0.54) AURKBAURKAKDRAXLNR1H4
SCHEMBL14447169 0.90 KDR (0.57) AURKBAURKAKDRAXLCSF1R
SCHEMBL5443568 0.90 KDR (0.58) AURKBAURKAKDRAXLCSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070155746-A1 NOVEL SUBSTITUTED PYRIDINYLOXY AND PYRIMIDINYLOXY AMIDES USEFUL AS INHIBITORS OF PROTEIN KINASES KALYPSYS, INC. (US) 2007-07-05 US disclosed
US-20070155746-A1 NOVEL SUBSTITUTED PYRIDINYLOXY AND PYRIMIDINYLOXY AMIDES USEFUL AS INHIBITORS OF PROTEIN KINASES KALYPSYS, INC. (US) 2007-07-05 US disclosed
US-20070155746-A1 NOVEL SUBSTITUTED PYRIDINYLOXY AND PYRIMIDINYLOXY AMIDES USEFUL AS INHIBITORS OF PROTEIN KINASES KALYPSYS, INC. (US) 2007-07-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070155746-A1 NOVEL SUBSTITUTED PYRIDINYLOXY AND PYRIMIDINYLOXY AMIDES USEFUL AS INHIBITORS OF PROTEIN KINASES BRAF, ARAF, RAF1 AURKB 488/4885AURKA 568/4885KDR 508/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.