SCHEMBL3914239

SCHEMBL3914239

COc1cc2c(Oc3ccc([N+](=O)[O-])cn3)ccnc2cc1OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MET P08581 7/20 0.52
KDR P35968 4/20 0.50
PDGFRA P16234 3/20 0.50
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SRC P12931 1/20 0.44
TGFBR1 P36897 1/20 0.44
FGFR2 P21802 1/20 0.44
CYP19A1 P11511 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
PDPK1 O15530 1/20 0.43
IGF1R P08069 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
SCHEMBL371888 0.89 PDGFRA (0.60) METKDRPDGFRALMNAMAPT
SCHEMBL30106564 0.89 PDGFRA (0.60) METKDRPDGFRALMNAMAPT
SCHEMBL1895559 0.87 PDGFRA (0.65) METKDRPDGFRAFGFR2
SCHEMBL4483017 0.84 MET (0.55) METKDRPDGFRA
SCHEMBL371803 0.84 MET (0.55) METKDRPDGFRA
SCHEMBL30713842 0.84 MET (0.55) METKDRPDGFRA
SCHEMBL25233743 0.83 KDR (0.48) METKDRPDGFRA
SCHEMBL30465509 0.83 KDR (0.48) METKDRPDGFRA
SCHEMBL15338440 0.82 PDGFRA (0.48) METKDRPDGFRALMNAMAPT
SCHEMBL3913550 0.81 PDGFRA (0.53) METKDRPDGFRALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE GAUDINO JOHN 2011-03-03 US disclosed
EP-2032538-A2 QUINOLINE COMPOUNDS AND METHODS OF USE Array Biopharma, Inc. (US) 2009-03-11 EP disclosed
WO-2007146824-A2 QUINOLINE COMPOUNDS AND METHODS OF USE ARRAY BIOPHARMA INC. (US) 2007-12-21 WO 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-20110053931-A1 QUINOLINE COMPOUNDS AND METHODS OF USE TK1, ABL1, ROR1 MET 563/4885KDR 498/4885PDGFRA 1413/4885

“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.