SCHEMBL20032550

SCHEMBL20032550

COc1cc2c(Oc3ccc([N+](=O)[O-])cc3F)ccnc2cc1OCC(C)(C)O

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.52
PDGFRA P16234 3/20 0.52
MET P08581 9/20 0.52
AXL P30530 3/20 0.52
FGFR2 P21802 2/20 0.52
FLT3 P36888 3/20 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
SCHEMBL29487188 0.90 PDGFRA (0.59) KDRPDGFRAMETAXLFGFR2
SCHEMBL174159 0.90 PDGFRA (0.59) KDRPDGFRAMETAXLFGFR2
SCHEMBL25259792 0.90 KDR (0.51) KDRPDGFRAMETAXLFGFR2
SCHEMBL20032555 0.88 PDGFRA (0.53) KDRPDGFRAMETAXLFGFR2
SCHEMBL31554535 0.87 FLT3 (0.54) KDRPDGFRAMETAXLFGFR2
SCHEMBL22009936 0.86 PDGFRA (0.56) KDRPDGFRAMETAXLFGFR2
SCHEMBL12635542 0.86 MET (0.53) KDRPDGFRAMETAXLFGFR2
SCHEMBL14310929 0.86 MET (0.55) KDRPDGFRAMETAXLFGFR2
SCHEMBL12004062 0.85 MET (0.51) KDRMETAXL
SCHEMBL165288 0.84 PDGFRA (0.52) KDRPDGFRAMETAXLFGFR2

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 KDR 2288/4885PDGFRA 3797/4885MET 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.