SCHEMBL4495253

SCHEMBL4495253

CC[C@@H](C)NC(=O)CCc1ccc(Oc2nc(Nc3cccc(OCCCN4CCCCC4)c3)ncc2C(=O)Nc2c(F)cc(F)cc2F)c(OC)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MET P08581 9/20 0.41
EPHX2 P34913 1/20 0.40
EGFR P00533 4/20 0.39
ITK Q08881 1/20 0.39
JAK3 P52333 1/20 0.38
BTK Q06187 1/20 0.38
LCK P06239 1/20 0.38
SRC P12931 1/20 0.38
KDR P35968 1/20 0.38
MAPK14 Q16539 1/20 0.38
INSR P06213 1/20 0.38

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 0.93 KDR (0.41) METJAK3BTKLCKSRC
SCHEMBL4493799 0.92 MET (0.40) METEGFRJAK3BTKLCK
SCHEMBL4484504 0.88 TNK2 (0.47) METJAK3BTKLCKSRC
SCHEMBL4500529 0.88 KDR (0.41) METEGFRJAK3BTKLCK
SCHEMBL4489536 0.86 LCK (0.43) METJAK3BTKLCKSRC
SCHEMBL5689051 0.85 KDR (0.37) METEGFRJAK3BTKLCK
SCHEMBL4499278 0.84 KDR (0.37) METEGFRJAK3BTKLCK
SCHEMBL4491816 0.84 LCK (0.47) METEGFRJAK3BTKLCK
SCHEMBL4482401 0.83 TNK2 (0.47) METJAK3BTKLCKSRC
SCHEMBL4492554 0.83 LCK (0.48) METEGFRJAK3BTKLCK

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 MET 2515/4885EPHX2 2819/4885EGFR 2918/4885

“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.