SCHEMBL4495452

SCHEMBL4495452

COCCN1CCN(CCCOc2ccc(Nc3ncc(C(N)=O)cn3)cc2F)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.48
CSF1R P07333 4/20 0.47
BTK Q06187 4/20 0.47
JAK3 P52333 1/20 0.46
AXL P30530 2/20 0.46
INSR P06213 1/20 0.46
SYK P43405 1/20 0.46
ITK Q08881 1/20 0.44
LCK P06239 1/20 0.43
SRC P12931 1/20 0.43
KDR P35968 1/20 0.43
MAPK14 Q16539 1/20 0.43

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
SCHEMBL5686178 0.93 CSF1R (0.52) EGFRCSF1RBTKJAK3AXL
SCHEMBL4494805 0.91 AXL (0.52) EGFRCSF1RBTKJAK3AXL
SCHEMBL4495092 0.90 AXL (0.51) EGFRCSF1RBTKJAK3AXL
SCHEMBL4507920 0.90 AXL (0.49) EGFRCSF1RBTKAXLINSR
SCHEMBL5689296 0.89 AXL (0.49) EGFRCSF1RBTKAXLINSR
SCHEMBL4494947 0.88 INSR (0.54) EGFRBTKJAK3AXLINSR
SCHEMBL4489929 0.88 AXL (0.57) EGFRCSF1RBTKJAK3AXL
SCHEMBL4499318 0.87 AXL (0.56) EGFRCSF1RBTKAXLINSR
SCHEMBL5689284 0.86 AXL (0.47) EGFRCSF1RBTKAXLINSR
SCHEMBL5686145 0.85 TNK2 (0.50) EGFRBTKJAK3INSRITK

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 EGFR 2918/4885CSF1R 893/4885BTK 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.