SCHEMBL14599467

SCHEMBL14599467

COc1cc2nccc(N3CCC(NC(=O)Nc4ccc(C(C)C)cc4)CC3)c2cc1OC

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIT P10721 3/20 0.58
PDGFRA P16234 3/20 0.58
PDGFRB P09619 3/20 0.54
FLT3 P36888 2/20 0.54
KDR P35968 1/20 0.51
EPHX2 P34913 3/20 0.50
NCF1 P14598 1/20 0.49
TP53 P04637 1/20 0.49
EPHX1 P07099 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
SMN1; SMN2 Q16637 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
SCHEMBL14599462 0.88 CCNC (0.50) EPHX2NCF1
SCHEMBL4966832 0.87 PDGFRB (0.71) KITPDGFRAPDGFRBFLT3KDR
SCHEMBL4965795 0.86 PDGFRB (0.66) KITPDGFRAPDGFRBFLT3KDR
SCHEMBL14599459 0.86 PDGFRB (0.54) KITPDGFRAPDGFRBFLT3NCF1
SCHEMBL4967296 0.81 PDGFRB (0.64) KITPDGFRAPDGFRBFLT3KDR
SCHEMBL5518895 0.80 EPHX2 (0.54) PDGFRBEPHX2TP53EPHX1NFKB1
SCHEMBL4969487 0.79 ENPP1 (0.53) KITPDGFRAPDGFRBFLT3KDR
SCHEMBL14599468 0.79 EPHX2 (0.48) KITPDGFRAKDREPHX2
SCHEMBL14599466 0.78 AURKA (0.61) FLT3KDREPHX2
SCHEMBL22455401 0.78 NCF1 (0.56) KITPDGFRAPDGFRBNCF1

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
US-20070004763-A1 AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-01-04 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-20070004763-A1 AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS FLT3, BMX, ABL1 KIT 104/4885PDGFRA 74/4885PDGFRB 51/4885

“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.