SCHEMBL7210605

SCHEMBL7210605

CN(C)CCSc1ncc(-c2ccc(F)cc2)c(-c2ccncc2)n1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 12/20 0.62
▸ MAPK13 O15264 10/20 0.62
▸ MAPK12 P53778 10/20 0.62
▸ MAPK11 Q15759 10/20 0.62
▸ MAPK10 P53779 1/20 0.57
▸ ALOX5 P09917 2/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ HTR7 P34969 1/20 0.43
▸ CSNK1D P48730 1/20 0.40
▸ CSNK1E P49674 1/20 0.40
▸ ADORA1 P30542 1/20 0.40

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
SCHEMBL7210216 0.77 PTGS2 (0.48) MAPK14MAPK13MAPK12MAPK11MAPK10
SCHEMBL7215179 0.73 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11MAPK10
SCHEMBL7210423 0.71 ADORA1 (0.51) MAPK14MAPK13MAPK12MAPK11MAPK10
SCHEMBL7215030 0.71 BRAF (0.51) MAPK14MAPK13MAPK12MAPK11MAPK10
SCHEMBL7222483 0.70 ADORA1 (0.75) MAPK14MAPK13MAPK12MAPK11MAPK10
SCHEMBL7210472 0.70 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11MAPK10
SCHEMBL7210550 0.70 ADORA1 (0.75) MAPK14MAPK13MAPK12MAPK11MAPK10
SCHEMBL7210591 0.70 PTGS2 (0.49) MAPK14MAPK13MAPK12MAPK11MAPK10
SCHEMBL7211811 0.70 PTGS2 (0.68) MAPK14MAPK13MAPK12MAPK11MAPK10
SCHEMBL7215273 0.69 PTGS2 (0.53) MAPK14MAPK13MAPK12MAPK11MAPK10

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-1314731-A2 Substituted pyrimidine compounds and their use AMGEN INC. (US) 2003-05-28 — — EP disclosed
EP-1314732-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 MAPK14 2062/4885MAPK13 2250/4885MAPK12 1502/4885

“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.

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