SCHEMBL5825145

SCHEMBL5825145

COc1cc2nccc(Oc3cc(C)c(NC(=S)NCCN4CCOCC4)cc3C)c2cc1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
KDM4E B2RXH2 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.51
AXL P30530 2/20 0.49
ACHE P22303 1/20 0.49
FLT3 P36888 3/20 0.48
MET P08581 7/20 0.48
KDR P35968 2/20 0.48
FGFR2 P21802 2/20 0.48
INSR P06213 2/20 0.48
PLK4 O00444 1/20 0.48
STK25 O00506 1/20 0.48
CIT O14578 1/20 0.48
AURKA O14965 1/20 0.48
CHUK O15111 1/20 0.48
MUSK O15146 1/20 0.48
EPHB6 O15197 1/20 0.48
MAPK13 O15264 1/20 0.48
MAP3K13 O43283 1/20 0.48

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
SCHEMBL5824408 0.95 AXL (0.52) ALDH1A1SMN1; SMN2KDM4EAXLFLT3
SCHEMBL5824630 0.93 ACHE (0.50) ACHEMETFGFR2SRCPDGFRA
SCHEMBL5825974 0.92 ACHE (0.52) ACHEMETFGFR2KITPDGFRA
SCHEMBL5824505 0.90 FLT3 (0.54) AXLFLT3METKDRFGFR2
SCHEMBL5825541 0.87 MET (0.49) KDM4EAXLFLT3METKDR
SCHEMBL5824601 0.84 KDR (0.56) AXLFLT3METKDRFGFR2
SCHEMBL5825310 0.84 AXL (0.54) ALDH1A1SMN1; SMN2KDM4EL3MBTL1AXL
SCHEMBL5824454 0.83 FLT3 (0.60) AXLFLT3METKDRFGFR2
SCHEMBL5824544 0.82 MET (0.52) FLT3METKDRPDGFRBKIT
SCHEMBL5208075 0.82 FLT3 (0.56) AXLFLT3METKDRFGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7135466-B2 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-14 US claimed
US-7135466-B2 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-11-14 US disclosed
US-20060211717-A1 Quinoline and quinazoline derivatives and drugs containing the same KIRIN BEER KABUSHIKI KAISHA (JP) 2006-09-21 US disclosed
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same KIRIN HOLDINGS KABUSHIKI KAISHA (JP) 2004-07-08 US disclosed
EP-1243582-A1 QUINOLINE AND QUINAZOLINE DERIVATIVES AND DRUGS CONTAINING THE SAME KIRIN BEER KABUSHIKI KAISHA (JP) 2002-09-25 EP 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 (2 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-20060211717-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA ALDH1A1 2003/4885SMN1; SMN2 4616/4885KDM4E 1657/4885
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA ALDH1A1 2059/4885SMN1; SMN2 4780/4885KDM4E 1526/4885

“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.