SCHEMBL307080

SCHEMBL307080

COC(=O)CC(=O)N(C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.50
POLQ O75417 2/20 0.50
MEN1 O00255 4/20 0.49
ALDH1A1 P00352 1/20 0.49
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PPIB P23284 1/20 0.44

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
SCHEMBL1760632 0.86 KMT2A (0.58) KMT2APOLQMEN1ALDH1A1CYP3A4
SCHEMBL8472209 0.86 SMN1; SMN2 (0.54) KMT2APOLQMEN1ALDH1A1
SCHEMBL307215 0.82 KMT2A (0.54) KMT2APOLQMEN1ALDH1A1CYP3A4
SCHEMBL23704985 0.82 HPGD (0.45) KMT2AMEN1ALDH1A1
SCHEMBL20680527 0.82 NOTUM (0.37) KMT2APOLQALDH1A1PPIB
SCHEMBL8179642 0.82 PPIB (0.51) KMT2AALDH1A1PPIB
SCHEMBL1006752 0.82 LMNA (0.48) KMT2AMEN1ALDH1A1
SCHEMBL6659655 0.81 KMT2A (0.53) KMT2APOLQMEN1ALDH1A1CYP3A4
SCHEMBL8181301 0.80 HSD17B2 (0.55)
SCHEMBL12679968 0.80 KCNA5 (0.44) KMT2APOLQMEN1ALDH1A1CYP3A4

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957498-B1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC (CA) 2017-02-15 EP disclosed
EP-1957498-B1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC (CA) 2017-02-15 EP disclosed
CN-101796055-B Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC 2013-09-04 CN disclosed
US-8329726-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-12-11 US disclosed
US-8329726-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-12-11 US disclosed
US-8329726-B2 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-12-11 US disclosed
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC. 2012-04-05 US disclosed
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC. 2012-04-05 US disclosed
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING METHYLGENE INC. 2012-04-05 US disclosed
US-8093264-B2 Fused heterocycles as inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE INC. (CA) 2012-01-10 US disclosed
US-7560557-B2 Process for the manufacture of quinoline derivatives ACTIVE BIOTECH AG (SE) 2009-07-14 US disclosed
EP-1511732-B9 PROCESS FOR THE MANUFACTURE OF QUINOLINE DERIVATIVES ACTIVE BIOTECH AB (SE) 2008-11-12 EP disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 US disclosed
US-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling METHYLGENE, INC. 2007-01-04 US disclosed
EP-1511732-B1 PROCESS FOR THE MANUFACTURE OF QUINOLINE DERIVATIVES ACTIVE BIOTECH AB (SE) 2006-12-20 EP disclosed
US-20050215586-A1 Process for the manufacture of quinoline derivatives ACTIVE BIOTECH AB (SE) 2005-09-29 US disclosed
US-6875869-B2 Process for the manufacture of quinoline derivatives ACTIVE BIOTECH AB (SE) 2005-04-05 US disclosed
US-20040034227-A1 Process for the manufacture of quinoline derivatives ACTIVE BIOTECH AB (SE) 2004-02-19 US disclosed
US-5912349-A Process for the preparation of roquinimex PHARMACIA & UPJOHN COMPANY (US) 1999-06-15 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 (4 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-20070004675-A1 Inhibitors of VEGF receptor and HGF receptor signaling HGF, MET, FLT1 KMT2A 3391/4885POLQ 1701/4885MEN1 3655/4885
US-20120083482-A1 INHIBITORS OF VEGF RECEPTOR AND HGF RECEPTOR SIGNALING HGF, MET, KDR KMT2A 2894/4885POLQ 3249/4885MEN1 4271/4885
US-20040034227-A1 Process for the manufacture of quinoline derivatives CYP4F3, HTR3C, CYP3A43 KMT2A 2359/4885POLQ 403/4885MEN1 2749/4885
US-20050215586-A1 Process for the manufacture of quinoline derivatives ADH5, RPS4Y1, CYP4F3 KMT2A 2223/4885POLQ 199/4885MEN1 2560/4885

“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.