SCHEMBL5468587

SCHEMBL5468587

O=C1Nc2cc(F)ccc2/C1=C\c1c[nH]c2ccccc12

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 5/20 0.73
PDGFRB P09619 5/20 0.73
RET P07949 3/20 0.73
KDR P35968 3/20 0.73
FLT3 P36888 3/20 0.73
PRKD3 O94806 2/20 0.73
ABL1 P00519 2/20 0.73
LTK P29376 2/20 0.73
CSNK1A1 P48729 2/20 0.73
CDK7 P50613 2/20 0.73
MAP2K1 Q02750 2/20 0.73
MST1R Q04912 2/20 0.73
NTRK3 Q16288 2/20 0.73
NTRK2 Q16620 2/20 0.73
AURKB Q96GD4 2/20 0.73
CLK4 Q9HAZ1 2/20 0.73
ALK Q9UM73 2/20 0.73
RPS6KA3 P51812 2/20 0.73
DAPK3 O43293 1/20 0.73
MAP4K4 O95819 1/20 0.73

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
SCHEMBL14448927 1.00 NTRK1 (0.73) NTRK1PDGFRBRETKDRFLT3
SCHEMBL5468592 1.00 NTRK1 (0.73) NTRK1PDGFRBRETKDRFLT3
SCHEMBL5469553 0.85 NTRK1 (0.73) NTRK1PDGFRBRETKDRFLT3
SCHEMBL5469550 0.85 NTRK1 (0.73) NTRK1PDGFRBRETKDRFLT3
SCHEMBL6861663 0.85 NTRK1 (0.73) NTRK1PDGFRBRETKDRFLT3
SCHEMBL14448948 0.85 NTRK1 (0.73) NTRK1PDGFRBRETKDRFLT3
SCHEMBL5465281 0.85 NTRK1 (0.73) NTRK1PDGFRBRETKDRFLT3
SCHEMBL5465283 0.85 NTRK1 (0.73) NTRK1PDGFRBRETKDRFLT3
SCHEMBL5476209 0.85 FLT3 (0.73) NTRK1PDGFRBRETKDRFLT3
SCHEMBL5476210 0.85 FLT3 (0.73) NTRK1PDGFRBRETKDRFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070167488-A1 Novel therapeutic use LEO PHARMA A/S (DK) 2007-07-19 US claimed
EP-1696906-A1 NOVEL THERAPEUTIC USE OF INDOLINONE DERIVATIVES Leo Pharma A/S (DK) 2006-09-06 EP claimed
EP-1680401-A2 INDOLINONE DERIVATIVES AND THEIR USE IN TREATING DISEASE-STATES SUCH AS CANCER Schering Aktiengesellschaft (DE) 2006-07-19 EP claimed
WO-2005058309-A1 NOVEL THERAPEUTIC USE OF INDOLINONE DERIVATIVES LEO PHARMA A/S (DK) 2005-06-30 WO claimed
WO-2005040116-A2 INDOLINONE DERIVATIVES AND THEIR USE IN TREATING DISEASE-STATES SUCH AS CANCER SCHERING AKTIENGESELLSCHAFT (DE) 2005-05-06 WO claimed
US-20050090541-A1 Indolinone derivatives and their use in treating disease-states such as cancer SCHERING AKTIENGESELLSCHAFT (DE) 2005-04-28 US claimed
US-20070167488-A1 Novel therapeutic use LEO PHARMA A/S (DK) 2007-07-19 US disclosed
WO-2006105796-A1 NOVEL INDOLINONE DERIVATIVES LEO PHARMA A/S (DK) 2006-10-12 WO disclosed
US-7105563-B2 Indolinone derivatives and their use in treating disease-states such as cancer SCHERING AKTIENGESELLSCHAFT (DE) 2006-09-12 US disclosed
EP-1696906-A1 NOVEL THERAPEUTIC USE OF INDOLINONE DERIVATIVES Leo Pharma A/S (DK) 2006-09-06 EP disclosed
EP-1680401-A2 INDOLINONE DERIVATIVES AND THEIR USE IN TREATING DISEASE-STATES SUCH AS CANCER Schering Aktiengesellschaft (DE) 2006-07-19 EP disclosed
WO-2005058309-A1 NOVEL THERAPEUTIC USE OF INDOLINONE DERIVATIVES LEO PHARMA A/S (DK) 2005-06-30 WO disclosed
WO-2005040116-A2 INDOLINONE DERIVATIVES AND THEIR USE IN TREATING DISEASE-STATES SUCH AS CANCER SCHERING AKTIENGESELLSCHAFT (DE) 2005-05-06 WO disclosed
US-20050090541-A1 Indolinone derivatives and their use in treating disease-states such as cancer SCHERING AKTIENGESELLSCHAFT (DE) 2005-04-28 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 (2 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-20050090541-A1 Indolinone derivatives and their use in treating disease-states such as cancer PDK3, PDK2, PDK4 NTRK1 642/4885PDGFRB 1462/4885RET 1754/4885
US-20070167488-A1 Novel therapeutic use MAG, PMP22, MYT1 NTRK1 175/4885PDGFRB 4421/4885RET 3720/4885

“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.