SCHEMBL5468533

SCHEMBL5468533

Cn1c(C=C2C(=O)Nc3ccccc32)cc2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.60
PSEN1 P49768 1/20 0.58
PSEN2 P49810 1/20 0.58
APH1B Q8WW43 1/20 0.58
NCSTN Q92542 1/20 0.58
APH1A Q96BI3 1/20 0.58
PSENEN Q9NZ42 1/20 0.58
NTRK1 P04629 2/20 0.55
MAP3K5 Q99683 1/20 0.55
GSK3B P49841 1/20 0.50
CSNK1D P48730 4/20 0.49
MAPK1 P28482 3/20 0.49
CSNK1A1 P48729 3/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
LMNA P02545 3/20 0.49
CSF1R P07333 2/20 0.49
RET P07949 2/20 0.49
FGFR1 P11362 2/20 0.49
SRC P12931 2/20 0.49

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
SCHEMBL5468527 1.00 KDR (0.60) KDRPSEN1PSEN2APH1BNCSTN
SCHEMBL14448935 1.00 KDR (0.60) KDRPSEN1PSEN2APH1BNCSTN
SCHEMBL21465 0.75 KDR (1.00) KDRNTRK1MAP3K5GSK3BCSNK1A1
SCHEMBL21466 0.75 KDR (1.00) KDRNTRK1MAP3K5GSK3BCSNK1A1
SCHEMBL5476227 0.73 PSEN1 (1.00) KDRPSEN1PSEN2APH1BNCSTN
SCHEMBL5476226 0.73 PSEN1 (1.00) KDRPSEN1PSEN2APH1BNCSTN
SCHEMBL1249978 0.72 GSK3B (0.54) GSK3BMEN1KMT2AHPGD
SCHEMBL1249974 0.72 GSK3B (0.54) GSK3BMEN1KMT2AHPGD
SCHEMBL5474794 0.72 CDK7 (0.60) KDRPSEN1PSEN2APH1BNCSTN
SCHEMBL16426734 0.72 CDK7 (0.60) KDRPSEN1PSEN2APH1BNCSTN

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 6 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
WO-2005058309-A1 NOVEL THERAPEUTIC USE OF INDOLINONE DERIVATIVES LEO PHARMA A/S (DK) 2005-06-30 WO claimed
US-20070167488-A1 Novel therapeutic use LEO PHARMA A/S (DK) 2007-07-19 US disclosed
EP-1696906-A1 NOVEL THERAPEUTIC USE OF INDOLINONE DERIVATIVES Leo Pharma A/S (DK) 2006-09-06 EP disclosed
WO-2005058309-A1 NOVEL THERAPEUTIC USE OF INDOLINONE DERIVATIVES LEO PHARMA A/S (DK) 2005-06-30 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-20070167488-A1 Novel therapeutic use MAG, PMP22, MYT1 KDR 4334/4885PSEN1 1618/4885PSEN2 822/4885

“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.