SCHEMBL4497798

SCHEMBL4497798

Cc1cccc(C)c1NC(=O)c1cnc(Nc2ccc(N3CCN(C(C)C)CC3)cc2)nc1Oc1ccc(C(F)(F)F)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 6/20 0.56
JAK3 P52333 3/20 0.56
BTK Q06187 1/20 0.56
TNK2 Q07912 1/20 0.56
CTSC P53634 2/20 0.50
SRC P12931 7/20 0.48
KDR P35968 4/20 0.47
MAPK14 Q16539 4/20 0.47
TEK Q02763 3/20 0.47
CSF1R P07333 2/20 0.47
ABL1 P00519 1/20 0.47
FYN P06241 1/20 0.47
LYN P07948 1/20 0.47
MAPK9 P45984 1/20 0.47
HCK P08631 1/20 0.46
FGFR1 P11362 1/20 0.46
DAPK1 P53355 1/20 0.45
MT-CO2 P00403 1/20 0.44
EGFR P00533 1/20 0.44
JAK2 O60674 1/20 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
SCHEMBL4505684 0.92 CTSC (0.59) LCKJAK3BTKTNK2CTSC
SCHEMBL4496676 0.91 LCK (0.59) LCKJAK3BTKTNK2SRC
SCHEMBL4508406 0.91 LCK (0.59) LCKJAK3BTKTNK2SRC
SCHEMBL4496883 0.91 LCK (0.59) LCKJAK3BTKTNK2SRC
SCHEMBL4487951 0.90 LCK (0.58) LCKJAK3BTKTNK2SRC
SCHEMBL4484606 0.89 LCK (0.65) LCKJAK3BTKTNK2SRC
SCHEMBL4485139 0.87 LCK (0.63) LCKJAK3BTKTNK2SRC
SCHEMBL4498259 0.86 LCK (0.62) LCKJAK3BTKTNK2SRC
SCHEMBL4502602 0.86 LCK (0.53) LCKJAK3BTKTNK2CTSC
SCHEMBL4509205 0.85 LCK (0.57) LCKJAK3BTKTNK2SRC

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 LCK 33/4885JAK3 900/4885BTK 1420/4885

“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.