SCHEMBL2746140

SCHEMBL2746140

CC(C)Nc1nccc(Oc2ccc3c(C(=O)Nc4ccc(Cl)cc4)cccc3c2)n1

nearest known ligand 0.82

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.82
AURKA O14965 1/20 0.60
LCK P06239 1/20 0.60
CSF1R P07333 1/20 0.60
MET P08581 1/20 0.60
BRAF P15056 1/20 0.60
FLT1 P17948 1/20 0.60
FGFR2 P21802 1/20 0.60
FLT4 P35916 1/20 0.60
TEK Q02763 1/20 0.60
AURKB Q96GD4 1/20 0.60

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
SCHEMBL2746996 0.92 KDR (0.69) KDRFLT1
SCHEMBL4548723 0.91 KDR (0.68) KDRFLT1FLT4
SCHEMBL4548777 0.90 KDR (1.00) KDRAURKALCKCSF1RMET
SCHEMBL4548721 0.90 KDR (0.66) KDR
SCHEMBL4548720 0.89 KDR (0.65) KDRFLT1FLT4
SCHEMBL4548724 0.89 KDR (0.64) KDRFLT1
SCHEMBL2748492 0.88 KDR (0.69) KDRFLT1
SCHEMBL4548722 0.87 KDR (0.68) KDRFLT1FLT4
SCHEMBL2747005 0.84 KDR (0.74) KDRBRAFFLT1FLT4
SCHEMBL2748197 0.84 KDR (0.60) KDRFLT1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8178557-B2 Compounds and methods of use AMGEN INC. (US) 2012-05-15 US disclosed
US-8178557-B2 Compounds and methods of use AMGEN INC. (US) 2012-05-15 US disclosed
US-8178557-B2 Compounds and methods of use AMGEN INC. (US) 2012-05-15 US disclosed
US-20090176774-A1 Compounds and methods of use AMGEN INC. (US) 2009-07-09 US disclosed
US-20090176774-A1 Compounds and methods of use AMGEN INC. (US) 2009-07-09 US disclosed
US-20090176774-A1 Compounds and methods of use AMGEN INC. (US) 2009-07-09 US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 US disclosed
US-7435823-B2 Compounds and methods of use AMGEN INC. (US) 2008-10-14 US disclosed
US-20060241115-A1 Compounds and methods of use AMGEN INC. 2006-10-26 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 (2 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-20060241115-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885AURKA 4148/4885LCK 1106/4885
US-20090176774-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885AURKA 4148/4885LCK 1106/4885

“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.