SCHEMBL4494447

SCHEMBL4494447

CN(C)CCCN(C)C(=O)c1cccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccccc2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.38
PLK1 P53350 4/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
ATR Q13535 1/20 0.35
KMT2A Q03164 2/20 0.35
MITF O75030 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
KDR P35968 2/20 0.35
PDGFRB P09619 1/20 0.35
KIT P10721 1/20 0.35
FGFR1 P11362 1/20 0.35
FLT3 P36888 1/20 0.35
PLK3 Q9H4B4 1/20 0.35
PRKCB P05771 1/20 0.34
PRKCA P17252 1/20 0.34
PRKCE Q02156 1/20 0.34
NPC1 O15118 1/20 0.34

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
SCHEMBL4494450 1.00 BRD4 (0.38) BRD4PLK1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL4496932 0.95 ATR (0.40) BRD4PLK1ALDH1A1SMN1; SMN2RXFP1
SCHEMBL4496928 0.95 ATR (0.40) BRD4PLK1ALDH1A1SMN1; SMN2RXFP1
SCHEMBL4493786 0.92 KDM4E (0.38) BRD4PLK1ALDH1A1KDM4ERXFP1
SCHEMBL4493789 0.92 KDM4E (0.38) BRD4PLK1ALDH1A1KDM4ERXFP1
SCHEMBL4481672 0.91 ALDH1A1 (0.44) BRD4PLK1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL4481674 0.91 ALDH1A1 (0.44) BRD4PLK1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL3845233 0.88 RAB9A (0.41) ALDH1A1SMN1; SMN2KMT2AKDRPDGFRB
SCHEMBL4494839 0.87 TMEM97 (0.46) ALDH1A1KDM4ERXFP1KMT2AKDR
SCHEMBL4494834 0.87 TMEM97 (0.46) ALDH1A1KDM4ERXFP1KMT2AKDR

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 BRD4 2704/4885PLK1 86/4885ALDH1A1 2036/4885

“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.