SCHEMBL7212196

SCHEMBL7212196

CCCCCNc1ncc(-c2ccc(F)cc2)c(-c2ccncc2)n1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MERTK Q12866 8/20 0.51
AXL P30530 5/20 0.51
PTGS2 P35354 1/20 0.48
KCNH3 Q9ULD8 1/20 0.46
MAPK13 O15264 4/20 0.46
MAPK12 P53778 4/20 0.46
MAPK11 Q15759 4/20 0.46
MAPK14 Q16539 4/20 0.46
ADORA1 P30542 2/20 0.46
TYRO3 Q06418 3/20 0.45
FLT3 P36888 2/20 0.45
LATS1 O95835 1/20 0.44
LATS2 Q9NRM7 1/20 0.44
GAS6 Q14393 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
SCHEMBL7216164 0.88 DYRK1B (0.47) MERTKAXLPTGS2MAPK13MAPK12
Hydrochloric Acid SCHEMBL7215189 0.87 DYRK1B (0.46) MERTKAXLPTGS2MAPK13MAPK12
SCHEMBL7210115 0.87 PTGS2 (0.47) MERTKAXLPTGS2MAPK13MAPK12
SCHEMBL7215273 0.87 PTGS2 (0.53) PTGS2MAPK13MAPK12MAPK11MAPK14
Hydrochloric Acid SCHEMBL7210261 0.86 PTGS2 (0.46) MERTKAXLPTGS2MAPK13MAPK12
SCHEMBL7210164 0.85 PTGS2 (0.49) PTGS2MAPK13MAPK12MAPK11MAPK14
SCHEMBL8501861 0.85 PTGS2 (0.45) MERTKAXLPTGS2MAPK13MAPK12
SCHEMBL7210483 0.84 PTGS2 (0.55) MERTKAXLPTGS2MAPK13MAPK12
SCHEMBL7211775 0.84 PTGS2 (0.48) PTGS2MAPK13MAPK12MAPK11MAPK14
SCHEMBL7210496 0.84 MAPK14 (0.47) MERTKAXLPTGS2MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6610698-B2 Treatment of tumor necrosis factor-alpha, interleukin-1 beta, interleukin-6, and interleukin-8 mediated diseases AMGEN, INC. 2003-08-26 US disclosed
EP-1314732-A2 Substituted pyrimidine compounds and their use AMGEN INC. (US) 2003-05-28 EP disclosed
EP-1314731-A2 Substituted pyrimidine compounds and their use AMGEN INC. (US) 2003-05-28 EP disclosed
US-20030069425-A1 Substituted pyrimidine compounds and methods of use AMGEN INC. 2003-04-10 US disclosed
US-6410729-B1 ANALGESICS; ANTIDIABETIC AGENTS; ANTIINFLAMMATORY AGENTS AMGEN INC. 2002-06-25 US disclosed
EP-0948497-A2 SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE Amgen inc. (US) 1999-10-13 EP disclosed
WO-1998024782-A2 SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AMGEN INC. (US) 1998-06-11 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-20030069425-A1 Substituted pyrimidine compounds and methods of use DPYD, IL6, IL1B MERTK 2028/4885AXL 1203/4885PTGS2 217/4885

“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.