SCHEMBL4503258

SCHEMBL4503258

CN(C)CCCc1ccc(NC(=C2C(=O)Nc3cc(Cl)ccc32)c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 12/20 0.43
PLK3 Q9H4B4 10/20 0.40
PDGFRB P09619 9/20 0.40
KDR P35968 9/20 0.40
KIT P10721 7/20 0.40
FGFR1 P11362 7/20 0.40
FLT3 P36888 7/20 0.40
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TMEM97 Q5BJF2 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
CNR1 P21554 1/20 0.35

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
SCHEMBL4503255 1.00 PLK1 (0.43) PLK1PLK3PDGFRBKDRKIT
SCHEMBL4488750 0.94 HRH3 (0.41) PLK1KDM4EALDH1A1TMEM97SIGMAR1
SCHEMBL4488747 0.94 HRH3 (0.41) PLK1KDM4EALDH1A1TMEM97SIGMAR1
SCHEMBL4493362 0.91 PLK1 (0.40) PLK1PLK3PDGFRBKDRKIT
SCHEMBL227165 0.91 PLK1 (0.41) PLK1PLK3PDGFRBKDRKIT
SCHEMBL227164 0.91 PLK1 (0.41) PLK1PLK3PDGFRBKDRKIT
SCHEMBL4493366 0.91 PLK1 (0.40) PLK1PLK3PDGFRBKDRKIT
SCHEMBL4490680 0.90 PLK1 (0.42) PLK1PLK3PDGFRBKDRKIT
SCHEMBL4490675 0.90 PLK1 (0.42) PLK1PLK3PDGFRBKDRKIT
SCHEMBL225176 0.89 PLK1 (0.45) PLK1PLK3PDGFRBKDRKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514468-B2 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-04-07 US disclosed
US-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-08-31 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 (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-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions KDR, FLT1, EGFR PLK1 86/4885PLK3 133/4885PDGFRB 105/4885

“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.