SCHEMBL4486009

SCHEMBL4486009

CC(C)(C(N)=O)N(c1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccccc2)cc1)S(C)(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.35
FLT3 P36888 4/20 0.35
FLT4 P35916 3/20 0.35
KIT P10721 2/20 0.35
CA2 P00918 3/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA9 Q16790 2/20 0.35
LRRK2 Q5S007 2/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
CES1 P23141 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
AURKB Q96GD4 2/20 0.33
PDGFRB P09619 1/20 0.33
CA4 P22748 1/20 0.33
CA7 P43166 1/20 0.33
SIRT2 Q8IXJ6 2/20 0.33

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
SCHEMBL4486132 0.91 CPT1A (0.36) KDRCA2CA12CA1CA9
SCHEMBL4507004 0.90 SHMT1 (0.35) KDRFLT3FLT4KITCA2
SCHEMBL4492090 0.90 BACE1 (0.39) KDRFLT3FLT4KITCA2
SCHEMBL226991 0.89 NR1H4 (0.35) KDRFLT3FLT4KITCA2
SCHEMBL226912 0.89 HSPH1 (0.34) KDRFLT3FLT4KITCA2
SCHEMBL6332015 0.86 RET (0.45) KDRFLT3FLT4MEN1MAPT
SCHEMBL2567995 0.85 BACE1 (0.35) FLT3MAPTKMT2ARXFP1AURKB
SCHEMBL4493065 0.84 KDR (0.33) KDRFLT3FLT4KITCA2
SCHEMBL4493060 0.84 KDR (0.33) KDRFLT3FLT4KITCA2
SCHEMBL4504950 0.84 MEN1 (0.43) KDRFLT3FLT4KITLRRK2

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 KDR 1/4885FLT3 34/4885FLT4 7/4885

“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.