SCHEMBL4485319

SCHEMBL4485319

CN(C)CCN(C)CC(=O)N(C)c1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccc(CC(=O)O)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
CYP26B1 Q9NR63 2/20 0.34
MAPT P10636 1/20 0.34
F10 P00742 1/20 0.34
CPT1A P50416 6/20 0.33
CPT1B Q92523 6/20 0.33
NR1H4 Q96RI1 2/20 0.33
SLC6A9 P48067 1/20 0.33
LTA4H P09960 1/20 0.33
PLK1 P53350 2/20 0.32
CYP26A1 O43174 1/20 0.31

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
SCHEMBL4485330 1.00 KDM4E (0.34) KDM4ECYP26B1MAPTF10CPT1A
SCHEMBL4485975 0.93 KDM4E (0.37) KDM4ECYP26B1MAPTCPT1ACPT1B
SCHEMBL4485968 0.93 KDM4E (0.37) KDM4ECYP26B1MAPTCPT1ACPT1B
SCHEMBL223538 0.92 PLK1 (0.34) F10NR1H4SLC6A9LTA4HPLK1
SCHEMBL223539 0.92 PLK1 (0.34) F10NR1H4SLC6A9LTA4HPLK1
SCHEMBL4504399 0.92 PLK1 (0.35) KDM4EMAPTNR1H4SLC6A9PLK1
SCHEMBL4504395 0.92 PLK1 (0.35) KDM4EMAPTNR1H4SLC6A9PLK1
SCHEMBL4493803 0.91 KDM4E (0.36) KDM4ECYP26B1MAPTCPT1ACPT1B
SCHEMBL4493805 0.91 KDM4E (0.36) KDM4ECYP26B1MAPTCPT1ACPT1B
SCHEMBL4488575 0.91 SLC6A9 (0.37) KDM4EMAPTF10SLC6A9PLK1

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 4 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
EP-1527046-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-05-04 EP disclosed
WO-2004009546-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-01-29 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-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions KDR, FLT1, EGFR KDM4E 1648/4885CYP26B1 494/4885MAPT 545/4885

“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.