SCHEMBL4492148

SCHEMBL4492148

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

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
MAPT P10636 1/20 0.34
CPT1A P50416 6/20 0.34
CPT1B Q92523 6/20 0.34
LRRK2 Q5S007 1/20 0.33
NR1H4 Q96RI1 2/20 0.31
CYP26A1 O43174 2/20 0.31
CYP26B1 Q9NR63 2/20 0.31
CSF1R P07333 1/20 0.31
HDAC1 Q13547 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
SCHEMBL4492150 1.00 KDM4E (0.34) KDM4EMAPTCPT1ACPT1BLRRK2
SCHEMBL4492761 0.95 KDM4E (0.35) KDM4EMAPTCPT1ACPT1BLRRK2
SCHEMBL4492767 0.95 KDM4E (0.35) KDM4EMAPTCPT1ACPT1BLRRK2
SCHEMBL227798 0.92 FFAR1 (0.34) LRRK2NR1H4CSF1R
SCHEMBL227797 0.92 FFAR1 (0.34) LRRK2NR1H4CSF1R
SCHEMBL4497412 0.92 NR1H4 (0.32) KDM4ELRRK2NR1H4
SCHEMBL4497409 0.92 NR1H4 (0.32) KDM4ELRRK2NR1H4
SCHEMBL4485666 0.92 KDM4E (0.35) KDM4EMAPTCPT1ACPT1BLRRK2
SCHEMBL4485660 0.92 KDM4E (0.35) KDM4EMAPTCPT1ACPT1BLRRK2
SCHEMBL4481431 0.91 LRRK2 (0.35) KDM4EMAPTLRRK2

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 1648/4885MAPT 545/4885CPT1A 1291/4885

“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.