SCHEMBL5070385

SCHEMBL5070385

COc1cc2ncc(C#N)c(N3CCC(NC(=O)Nc4ccc(OC(C)C)cc4)C3)c2cc1OC

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 6/20 0.51
PDGFRB P09619 9/20 0.49
KIT P10721 4/20 0.46
PDGFRA P16234 2/20 0.46
KDR P35968 1/20 0.46
FLT3 P36888 2/20 0.44
CSF1R P07333 1/20 0.44
CCNC P24863 2/20 0.44
CDK8 P49336 2/20 0.44
MAP2K1 Q02750 1/20 0.43

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
SCHEMBL4969487 0.91 ENPP1 (0.53) ENPP1PDGFRBKITPDGFRAKDR
SCHEMBL4969302 0.86 PDGFRB (0.49) ENPP1PDGFRBKITFLT3CSF1R
SCHEMBL4968636 0.85 ENPP1 (0.51) ENPP1PDGFRBKITFLT3CSF1R
SCHEMBL4970207 0.83 PDGFRB (0.67) PDGFRBKITPDGFRAKDRFLT3
SCHEMBL4965855 0.80 PDGFRB (0.72) PDGFRBKITPDGFRAKDRFLT3
SCHEMBL4970316 0.77 ERBB2 (0.52) ENPP1PDGFRBKITPDGFRAFLT3
SCHEMBL4968261 0.75 ERBB2 (0.54) ENPP1PDGFRBKITPDGFRAFLT3
SCHEMBL4965795 0.73 PDGFRB (0.66) ENPP1PDGFRBKITPDGFRAKDR
SCHEMBL24392346 0.73 ENPP1 (0.62) ENPP1
SCHEMBL4965483 0.72 ENPP1 (0.62) ENPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893206-A2 SYNERGISTIC MODULATION OF FLT3 KINASE USING AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-03-05 EP disclosed
US-20070004763-A1 AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-01-04 US disclosed
US-20070004763-A1 AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-01-04 US disclosed
US-20070004763-A1 AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-01-04 US disclosed
WO-2006135636-A2 SYNERGISTIC MODULATION OF FLT3 KINASE USING AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-21 WO disclosed
US-20060281771-A1 SYNERGISTIC MODULATION OF FLT3 KINASE USING AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-12-14 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 (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-20060281771-A1 SYNERGISTIC MODULATION OF FLT3 KINASE USING AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS FLT3, CDC42BPG, PRKCQ ENPP1 1922/4885PDGFRB 284/4885KIT 197/4885
US-20070004763-A1 AMINOQUINOLINE AND AMINOQUINAZOLINE KINASE MODULATORS FLT3, BMX, ABL1 ENPP1 2497/4885PDGFRB 51/4885KIT 104/4885

“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.