SCHEMBL5825571

SCHEMBL5825571

COc1cc2nccc(Oc3ccc(NC(=O)NC4CCN(Cc5ccccc5)CC4)cc3C)c2cc1OC

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MET P08581 9/20 0.57
PDGFRA P16234 2/20 0.57
KIT P10721 1/20 0.57
TSHR P16473 1/20 0.56
AXL P30530 1/20 0.54
DCUN1D1 Q96GG9 2/20 0.54
SIGMAR1 Q99720 2/20 0.53
KDR P35968 1/20 0.51
DRD2 P14416 1/20 0.51
DRD4 P21917 1/20 0.51
DRD3 P35462 1/20 0.51
KMT2A Q03164 1/20 0.51
NSD2 O96028 1/20 0.51
UBE2M P61081 1/20 0.51
MCHR1 Q99705 1/20 0.50

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
SCHEMBL5824580 0.92 MET (0.57) METPDGFRAKITTSHRDCUN1D1
SCHEMBL5825752 0.92 MET (0.68) METKDR
SCHEMBL5825390 0.90 PDGFRA (0.71) METPDGFRAKITAXLSIGMAR1
SCHEMBL5824840 0.89 TSHR (0.58) METPDGFRAKITTSHRDCUN1D1
SCHEMBL5825107 0.88 TSHR (0.61) METPDGFRAKITTSHRDCUN1D1
SCHEMBL5824479 0.85 SIGMAR1 (0.63) METPDGFRAKITTSHRSIGMAR1
SCHEMBL5825593 0.85 PDGFRA (0.67) METPDGFRAKITAXLKDR
SCHEMBL5824713 0.85 PDGFRA (0.67) METPDGFRAKITAXLKDR
SCHEMBL5824718 0.85 PDGFRA (0.67) METPDGFRAKITAXLKDR
SCHEMBL5825260 0.83 PDGFRA (0.68) METPDGFRAKITAXLKDR

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 MET 84/4885PDGFRA 1/4885KIT 401/4885
US-20040132727-A1 Quinoline and quinazoline derivatives and drugs containing the same PDGFRA, PDGFRB, PDGFA MET 40/4885PDGFRA 1/4885KIT 499/4885

“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.