SCHEMBL429466

SCHEMBL429466

O=C(Nc1cccc(F)c1)c1ccc(Cl)nc1NCc1ccncc1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 18/20 0.60
NAMPT P43490 1/20 0.53
FLT1 P17948 3/20 0.52
ABL1 P00519 1/20 0.52
EGFR P00533 1/20 0.52
CSF1R P07333 1/20 0.52
PDGFRB P09619 1/20 0.52
KIT P10721 1/20 0.52
FLT4 P35916 1/20 0.52
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL429478 0.89 KDR (0.75) KDRNAMPTFLT1ABL1EGFR
SCHEMBL14515361 0.88 KDR (0.45) KDRNAMPTFLT1ABL1EGFR
SCHEMBL429454 0.84 KDR (0.73) KDRFLT1MAPT
SCHEMBL429462 0.82 KDR (0.71) KDRNAMPTFLT1
SCHEMBL427738 0.80 KDR (0.68) KDRFLT1ABL1EGFRCSF1R
SCHEMBL429755 0.78 HTT (0.52) KDRNAMPT
SCHEMBL3060372 0.77 KDR (0.48) KDRFLT1
SCHEMBL3055165 0.76 KDM5B (0.49) KDRFLT1KDM4EMEN1KMT2A
SCHEMBL427506 0.75 KDR (1.00) KDRFLT1ABL1EGFRCSF1R
SCHEMBL426410 0.74 KDR (0.70) KDRFLT1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642624-B2 Substituted alkylamine derivatives and methods of use AMGEN INC. (US) 2014-02-04 US disclosed
US-8642624-B2 Substituted alkylamine derivatives and methods of use AMGEN INC. (US) 2014-02-04 US disclosed
US-20120065185-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-03-15 US disclosed
US-20120065185-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AMGEN INC. (US) 2012-03-15 US disclosed
US-8058445-B2 Substituted pyridinecarboxamides for the treatment of cancer AMGEN INC. (US) 2011-11-15 US disclosed
US-7687643-B2 Process for preparing 3,3-dimethylindolines AMGEN INC. (US) 2010-03-30 US disclosed
US-7687643-B2 Process for preparing 3,3-dimethylindolines AMGEN INC. (US) 2010-03-30 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-20120065185-A1 SUBSTITUTED ALKYLAMINE DERIVATIVES AND METHODS OF USE AADAC, NAT1, PIGO KDR 8/4885NAMPT 261/4885FLT1 11/4885

“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.