SCHEMBL4496504

SCHEMBL4496504

Cc1cccc(C)c1NC(=O)c1cnc(Nc2ccc(OCCCN3CCN(C)CC3)c(F)c2)nc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.52
LCK P06239 6/20 0.52
SRC P12931 5/20 0.52
MAPK14 Q16539 3/20 0.52
TNK2 Q07912 2/20 0.49
MET P08581 3/20 0.47
SIK1 P57059 2/20 0.47
SIK2 Q9H0K1 2/20 0.47
SIK3 Q9Y2K2 2/20 0.47
BTK Q06187 2/20 0.45
EGFR P00533 1/20 0.45
BRAF P15056 1/20 0.45
JAK3 P52333 1/20 0.44
CSF1R P07333 2/20 0.44

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
SCHEMBL5686145 0.94 TNK2 (0.50) KDRLCKSRCMAPK14TNK2
SCHEMBL4497531 0.93 KDR (0.47) KDRLCKSRCMAPK14TNK2
SCHEMBL5689079 0.93 KDR (0.47) KDRLCKSRCMAPK14TNK2
SCHEMBL4496395 0.93 TNK2 (0.56) KDRLCKSRCMAPK14TNK2
SCHEMBL5686279 0.91 CSF1R (0.50) KDRLCKSRCMAPK14TNK2
SCHEMBL4503003 0.90 MET (0.45) KDRLCKSRCMAPK14MET
SCHEMBL5686260 0.88 KDR (0.49) KDRLCKSRCMAPK14TNK2
SCHEMBL5689288 0.88 CSF1R (0.48) KDRLCKSRCMAPK14MET
SCHEMBL4481044 0.87 EGFR (0.47) KDRLCKSRCMAPK14MET
SCHEMBL4500256 0.87 KDR (0.50) KDRLCKSRCMAPK14TNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504396-B2 Substituted heterocyclic compounds and methods of use AMGEN INC. (US) 2009-03-17 US disclosed
EP-1648464-A1 2-AMINO-4-HYDROXY-5-PYRIMIDINCARBOXAMID DERIVATIVES AND RELATED COMPOUNDS AS T-CELL ACTIVATION INHIBITORS FOR THE TREATMENT OF INFLAMMATIONS AMGEN INC. (US) 2006-04-26 EP disclosed
US-20050209221-A1 Substituted heterocyclic compounds and methods of use AMGEN INC. 2005-09-22 US disclosed
WO-2005009443-A1 2-AMINO-4-HYDROXY-5-PYRIMIDINECARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS INHIBITORS OF T CELL ACTIVATION FOR THE TREATMENT OF INFLAMMATORY DISEASES AMGEN INC. (US) 2005-02-03 WO 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.