SCHEMBL5249348

SCHEMBL5249348

O=C(NOCc1ccccc1)c1ccccc1Sc1ccc2c(/C=C/c3ccccn3)n[nH]c2c1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.81
FGFR1 P11362 7/20 0.81
LCK P06239 3/20 0.72
PLK4 O00444 2/20 0.72
AURKA O14965 2/20 0.72
MAP4K4 O95819 2/20 0.72
PAK4 O96013 2/20 0.72
ABL1 P00519 2/20 0.72
CSF1R P07333 2/20 0.72
RET P07949 2/20 0.72
MET P08581 2/20 0.72
PDGFRB P09619 2/20 0.72
KIT P10721 2/20 0.72
PDGFRA P16234 2/20 0.72
FLT1 P17948 2/20 0.72
FGFR3 P22607 2/20 0.72
TYK2 P29597 2/20 0.72
AXL P30530 2/20 0.72
FLT4 P35916 2/20 0.72
BLK P51451 2/20 0.72

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
SCHEMBL5249159 0.90 KDR (1.00) KDRFGFR1LCKPLK4AURKA
SCHEMBL5252617 0.88 KDR (0.87) KDRFGFR1LCKPLK4AURKA
SCHEMBL5247581 0.88 KDR (0.81) KDRFGFR1LCKPLK4AURKA
SCHEMBL5249236 0.88 KDR (0.82) KDRFGFR1LCKPLK4AURKA
SCHEMBL5246970 0.87 KDR (1.00) KDRFGFR1LCKPLK4AURKA
SCHEMBL5252094 0.87 KDR (0.79) KDRFGFR1LCKPLK4AURKA
SCHEMBL24503457 0.85 KDR (0.84) KDRFGFR1LCKPLK4AURKA
SCHEMBL5250041 0.85 KDR (0.82) KDRFGFR1LCKPLK4AURKA
SCHEMBL5248921 0.84 KDR (1.00) KDRFGFR1LCKPLK4AURKA
Axitinib SCHEMBL172918 0.84 KDR (1.00) KDRFGFR1LCKPLK4AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1614683-B1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMA (US) 2007-11-21 EP disclosed
EP-1218348-B1 INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE AGOURON PHARMA (US) 2007-10-24 EP disclosed
US-7141587-B2 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2006-11-28 US disclosed
EP-1614683-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2006-01-11 EP disclosed
US-20050124662-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS. INC. 2005-06-09 US disclosed
US-6891044-B2 Indazole compounds and pharmaceutical compositions for Inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2005-05-10 US disclosed
US-6884890-B2 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, INC. (US) 2005-04-26 US disclosed
US-20040220248-A1 INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE KANIA ROBERT STEVEN (US) 2004-11-04 US disclosed
US-20040171634-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use AGOURON PHARMACEUTICALS, LLC 2004-09-02 US disclosed
US-6534524-B1 Antiproliferative agents, including axitinib AGOURON PHARMACEUTICALS, INC. 2003-03-18 US disclosed
EP-1218348-A2 INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE AGOURON PHARMACEUTICALS, INC. (US) 2002-07-03 EP disclosed
WO-2001002369-A2 INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE AGOURON PHARMACEUTICALS, INC. (US) 2001-01-11 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 (3 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-20040171634-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use CDK3, BRAF, ROCK1 KDR 60/4885FGFR1 262/4885LCK 39/4885
US-20050124662-A1 Indazole compounds and pharmaceutical compositions for inhibiting protein kinases, and methods for their use CDK3, BRAF, ROCK1 KDR 60/4885FGFR1 262/4885LCK 39/4885
US-20040220248-A1 INDAZOLE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS FOR INHIBITING PROTEIN KINASES, AND METHODS FOR THEIR USE CDK3, BRAF, ROCK1 KDR 60/4885FGFR1 262/4885LCK 39/4885

“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.