SCHEMBL3502017

SCHEMBL3502017

O=c1[nH]c2cc(F)c(F)cc2cc1-c1nc2ccccc2[nH]1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.72
PDGFRB P09619 3/20 0.72
FGFR1 P11362 3/20 0.72
NPC1 O15118 10/20 0.57
RAB9A P51151 10/20 0.57
ALDH1A1 P00352 8/20 0.57
PKM P14618 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
GBA1 P04062 1/20 0.52
KDM4E B2RXH2 7/20 0.49
SMN1; SMN2 Q16637 5/20 0.49
NPSR1 Q6W5P4 3/20 0.49
HSD17B10 Q99714 3/20 0.49
ABCB11 O95342 1/20 0.49
TP53 P04637 1/20 0.49
USP2 O75604 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CASP3 P42574 1/20 0.47
ATM Q13315 1/20 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
SCHEMBL3502778 0.86 KDR (0.61) KDRPDGFRBFGFR1NPC1RAB9A
SCHEMBL3500603 0.85 KDR (0.74) KDRPDGFRBFGFR1NPC1RAB9A
SCHEMBL4298828 0.85 KDR (0.74) KDRPDGFRBFGFR1NPC1RAB9A
SCHEMBL3503147 0.84 KDR (1.00) KDRPDGFRBFGFR1NPC1RAB9A
SCHEMBL3501208 0.83 KDR (0.72) KDRPDGFRBFGFR1NPC1RAB9A
SCHEMBL3502748 0.82 KDR (0.66) KDRPDGFRBFGFR1NPC1RAB9A
SCHEMBL3504240 0.82 KDR (0.48) KDRPDGFRBFGFR1NPC1RAB9A
SCHEMBL3499041 0.82 KDR (0.65) KDRPDGFRBFGFR1NPC1RAB9A
SCHEMBL3502903 0.80 KDR (0.74) KDRPDGFRBFGFR1NPC1RAB9A
SCHEMBL3501686 0.80 KDR (0.74) KDRPDGFRBFGFR1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103570678-B 2-quinolinone compound and preparation method and application thereof UNIV SHANXI 2015-04-15 CN disclosed
CN-103570678-B 2-quinolinone compound and preparation method and application thereof UNIV SHANXI 2015-04-15 CN disclosed
CN-103570678-A 2-quinolinone compound and preparation method and application thereof UNIV SHANXI 2014-02-12 CN disclosed
US-20100184754-A1 QUINOLINONE DERIVATIVES NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2010-07-22 US disclosed
US-7598268-B2 Quinolinone derivatives NOVARTIS VACCINES & DIAGNOSTICS, INC. (US) 2009-10-06 US disclosed
US-20080070906-A1 QUINOLINONE DERIVATIVES NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2008-03-20 US disclosed
US-7335774-B2 Quinolinone derivatives NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2008-02-26 US disclosed
US-20050209456-A1 Vascular endothelial growth factor; tyrosine kinase inhibitor; angiogenesis inhibitor; anticancer agents CHIRON CORPORATION 2005-09-22 US disclosed
US-20050054672-A1 Vascular endothelial growth factor; tyrosine kinase inhibitor;angiogenesis inhibitor; anticarcinogenic agents CHIRON CORPORATION 2005-03-10 US disclosed
US-6800760-B2 INHIBITORS OF VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR TYROSINE KINASE CHIRON CORPORATION 2004-10-05 US disclosed
US-6774237-B2 VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR TYROSINE KINASES INHIBITORS; ANGIOGENESIS INHIBITORS, ANTICARCINOGENIC AGENTS CHIRON CORPORATION 2004-08-10 US disclosed
US-6762194-B2 VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR TYROSINE KINASE INHIBITORS CHIRON CORPORATION 2004-07-13 US disclosed
US-6605617-B2 Treating a patient in need of an inhibitor of vascular endothelial growth factor receptor tyrosine kinase CHIRON CORPORATION 2003-08-12 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 (4 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-20080070906-A1 QUINOLINONE DERIVATIVES SLCO1B1, SLCO1B3, SLCO1A2 KDR 4147/4885PDGFRB 4032/4885FGFR1 2959/4885
US-20050054672-A1 Vascular endothelial growth factor; tyrosine kinase inhibitor;angiogenesis inhibitor; anticarcinogenic agents VEGFA, FLT1, KDR KDR 3/4885PDGFRB 49/4885FGFR1 10/4885
US-20050209456-A1 Vascular endothelial growth factor; tyrosine kinase inhibitor; angiogenesis inhibitor; anticancer agents KDR, FLT4, FLT1 KDR 1/4885PDGFRB 26/4885FGFR1 23/4885
US-20100184754-A1 QUINOLINONE DERIVATIVES SLCO1B1, SLCO1B3, SLCO1A2 KDR 4147/4885PDGFRB 4032/4885FGFR1 2959/4885

“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.