SCHEMBL2984656

SCHEMBL2984656

CC1(C)C(=O)NC(=O)N1CCNc1nccc(-c2cc3cc(N)ccc3s2)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 1/20 0.37
MAPK1 P28482 1/20 0.37
IKBKB O14920 8/20 0.35
CHUK O15111 6/20 0.35
IKBKG Q9Y6K9 6/20 0.35
CDK2 P24941 3/20 0.33
CLK1 P49759 1/20 0.33
AKT3 Q9Y243 1/20 0.33
MKNK1 Q9BUB5 1/20 0.32
CDC7 O00311 1/20 0.32
AURKA O14965 2/20 0.31
TTK P33981 1/20 0.31
AURKB Q96GD4 1/20 0.31
INCENP Q9NQS7 1/20 0.31
SYK P43405 1/20 0.31
CDK4 P11802 2/20 0.31
EIF2AK2 P19525 2/20 0.31
CDK1 P06493 1/20 0.31
CDK7 P50613 1/20 0.31
CDK9 P50750 1/20 0.31

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
SCHEMBL2985979 0.88 IKBKB (0.46) MAPK3MAPK1IKBKBCHUKIKBKG
SCHEMBL2985653 0.88 IKBKB (0.37) MAPK3MAPK1IKBKBCHUKIKBKG
SCHEMBL2988794 0.87 POLB (0.37) MAPK3MAPK1IKBKBCHUKIKBKG
SCHEMBL2989813 0.86 IKBKB (0.38) MAPK3MAPK1IKBKBCHUKIKBKG
SCHEMBL5147363 0.86 IKBKB (0.36) MAPK3MAPK1IKBKBCHUKIKBKG
SCHEMBL2983663 0.85 IKBKB (0.39) MAPK3MAPK1IKBKBCHUKIKBKG
SCHEMBL2985350 0.84 CDK2 (0.37) MAPK3MAPK1IKBKBCHUKIKBKG
SCHEMBL2975941 0.83 IKBKB (0.38) MAPK3MAPK1IKBKBCHUKIKBKG
SCHEMBL2983796 0.83 IKBKB (0.38) MAPK3MAPK1IKBKBCHUKIKBKG
SCHEMBL2986248 0.83 ABL1 (0.31)

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
EP-1831207-B1 AMINOPYRIMIDINE COMPOUNDS AS PLK INHIBITORS AMGEN INC (US) 2012-11-14 EP disclosed
US-7858785-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-12-28 US disclosed
US-7786132-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-08-31 US disclosed
US-20100010014-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2010-01-14 US disclosed
EP-1831207-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-09-12 EP disclosed
US-20070185133-A1 Aminopyrimidine compounds and methods of use AMGEN, INC. (US) 2007-08-09 US disclosed
WO-2006066172-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN, INC. (US) 2006-06-22 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 (2 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-20100010014-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE PLK1, TYMP, TK2 MAPK3 1361/4885MAPK1 1111/4885IKBKB 1952/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 MAPK3 1361/4885MAPK1 1111/4885IKBKB 1952/4885

“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.