SCHEMBL4548755

SCHEMBL4548755

CNC(=O)c1cc(Oc2ccc3c(NC(=O)c4ccc(OC)cc4)cccc3c2)ccn1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.58
KMT2A Q03164 2/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
BRAF P15056 5/20 0.53
SIRT2 Q8IXJ6 2/20 0.52
SIRT1 Q96EB6 2/20 0.52
SIRT3 Q9NTG7 2/20 0.52
FGFR1 P11362 6/20 0.51
FGFR2 P21802 1/20 0.50
FGFR3 P22607 1/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CSF1R P07333 1/20 0.48

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
SCHEMBL4548754 0.92 KDR (0.57) KDRKMT2ANPC1RAB9ABRAF
SCHEMBL2747087 0.92 SIRT2 (0.62) KDRBRAFSIRT2SIRT1SIRT3
SCHEMBL2746237 0.92 KDR (0.60) KDRBRAFSIRT2SIRT1SIRT3
SCHEMBL2749251 0.91 KDR (0.70) KDRBRAFSIRT2SIRT1SIRT3
SCHEMBL2747536 0.91 KDR (0.58) KDRBRAFSIRT2SIRT1SIRT3
SCHEMBL2747211 0.91 KDR (0.58) KDRBRAFSIRT2SIRT1SIRT3
SCHEMBL4548758 0.91 KDR (0.59) KDRBRAFSIRT2SIRT1SIRT3
SCHEMBL4548768 0.91 KDR (0.55) KDRKMT2ABRAFSIRT2SIRT1
SCHEMBL2747846 0.90 KDR (0.57) KDRKMT2ABRAFSIRT2SIRT1
SCHEMBL4556583 0.90 KDR (0.57) KDRBRAFSIRT2SIRT1SIRT3

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 8 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-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 354/4885KMT2A 3644/4885NPC1 143/4885
US-20090176774-A1 Compounds and methods of use HGF, HGFAC, MET KDR 354/4885KMT2A 3644/4885NPC1 143/4885

“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.