SCHEMBL20032555

SCHEMBL20032555

COc1cc2c(Oc3ccc([N+](=O)[O-])cc3F)ccnc2cc1OCCO

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 3/20 0.53
KDR P35968 2/20 0.53
MET P08581 6/20 0.53
FGFR2 P21802 2/20 0.53
AXL P30530 4/20 0.49
FLT3 P36888 4/20 0.47

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
SCHEMBL31554535 0.91 FLT3 (0.54) PDGFRAKDRMETFGFR2AXL
SCHEMBL174159 0.91 PDGFRA (0.59) PDGFRAKDRMETFGFR2AXL
SCHEMBL29487188 0.91 PDGFRA (0.59) PDGFRAKDRMETFGFR2AXL
SCHEMBL14310929 0.90 MET (0.55) PDGFRAKDRMETFGFR2AXL
SCHEMBL12635542 0.90 MET (0.53) PDGFRAKDRMETFGFR2AXL
SCHEMBL29168459 0.88 MET (0.55) PDGFRAKDRMETAXLFLT3
SCHEMBL5056236 0.88 FLT3 (0.52) PDGFRAKDRMETAXLFLT3
SCHEMBL20032550 0.88 KDR (0.52) PDGFRAKDRMETFGFR2AXL
SCHEMBL22009936 0.87 PDGFRA (0.56) PDGFRAKDRMETFGFR2AXL
SCHEMBL13936618 0.85 PDGFRA (0.52) PDGFRAKDRMETFGFR2AXL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180099962-A1 NAPHTHYRIDINE COMPOUNDS, MEDICAL COMBINATIONS AND USE THEREOF NANJING NATINEFY PHARMATECH CO., LTD. (CN) 2018-04-12 US disclosed
US-9938274-B1 Naphthyridine compounds, medical combinations and use thereof NANJING NATINEFY PHARMATECH CO., LTD. (CN) 2018-04-10 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-20180099962-A1 NAPHTHYRIDINE COMPOUNDS, MEDICAL COMBINATIONS AND USE THEREOF NPM1, NEK4, NME1 PDGFRA 3797/4885KDR 2288/4885MET 837/4885

“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.