SCHEMBL4500529

SCHEMBL4500529

CC[C@@H](C)NC(=O)CCc1ccc(Oc2nc(Nc3ccc(OCCCN4CCN(C)CC4)c(F)c3)ncc2C(=O)Nc2c(F)cc(F)cc2F)c(OC)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 3/20 0.41
LCK P06239 1/20 0.41
SRC P12931 1/20 0.41
MAPK14 Q16539 1/20 0.41
CSF1R P07333 2/20 0.41
MET P08581 13/20 0.40
KIT P10721 3/20 0.39
FLT3 P36888 3/20 0.39
PDGFRB P09619 2/20 0.39
PDGFRA P16234 2/20 0.39
ALK Q9UM73 2/20 0.39
FLT4 P35916 1/20 0.39
AXL P30530 2/20 0.38
EGFR P00533 2/20 0.38
JAK3 P52333 1/20 0.38
BTK Q06187 1/20 0.38
MST1R Q04912 1/20 0.37

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
SCHEMBL4493132 0.95 KDR (0.41) KDRLCKSRCMAPK14MET
SCHEMBL5689051 0.94 KDR (0.37) KDRLCKSRCMAPK14CSF1R
SCHEMBL4491816 0.93 LCK (0.47) KDRLCKSRCMAPK14CSF1R
SCHEMBL4496292 0.93 KDR (0.43) KDRLCKSRCMAPK14CSF1R
SCHEMBL4499278 0.93 KDR (0.37) KDRLCKSRCMAPK14CSF1R
SCHEMBL4489536 0.89 LCK (0.43) KDRLCKSRCMAPK14MET
SCHEMBL4484504 0.89 TNK2 (0.47) KDRLCKSRCMAPK14MET
SCHEMBL4495253 0.88 MET (0.41) KDRLCKSRCMAPK14MET
SCHEMBL4501597 0.88 LCK (0.46) KDRLCKSRCMAPK14CSF1R
SCHEMBL4499188 0.88 EGFR (0.36) KDRLCKEGFRJAK3BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 US claimed
US-7504396-B2 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2009-03-17 US disclosed
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 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-20050209221-A1 Substituted heterocyclic compounds and methods of use ICOS, CD4, HLA-DRB1 KDR 3785/4885LCK 33/4885SRC 2472/4885

“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.