SCHEMBL3073614

SCHEMBL3073614

CC1(C)C(=O)NC(=O)N1CCNc1nccc(-c2cc3cc(NC(=O)c4ccccc4F)ccc3s2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 8/20 0.41
CHUK O15111 6/20 0.41
IKBKG Q9Y6K9 6/20 0.41
MAPT P10636 4/20 0.38
LMNA P02545 3/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPK1 P28482 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KIT P10721 1/20 0.37
BRAF P15056 1/20 0.37
PDGFRB P09619 2/20 0.36
KDR P35968 2/20 0.36
SYK P43405 2/20 0.36
TLK2 Q86UE8 1/20 0.36
AURKA O14965 1/20 0.35
AURKB Q96GD4 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL2978246 0.90 IKBKB (0.38) IKBKBCHUKIKBKGMEN1KMT2A
SCHEMBL2984268 0.90 PDGFRB (0.46) IKBKBCHUKIKBKGMEN1KMT2A
SCHEMBL2981709 0.89 IKBKB (0.38) IKBKBCHUKIKBKGMAPTMEN1
SCHEMBL2987595 0.89 IKBKB (0.41) IKBKBCHUKIKBKGNPC1RAB9A
SCHEMBL2986367 0.88 IKBKB (0.38) IKBKBCHUKIKBKGMEN1KMT2A
SCHEMBL2983663 0.87 IKBKB (0.39) IKBKBCHUKIKBKGMEN1KMT2A
SCHEMBL2983547 0.87 IKBKB (0.41) IKBKBCHUKIKBKGMEN1KMT2A
SCHEMBL2990209 0.85 PDGFRB (0.43) IKBKBCHUKIKBKGMAPTLMNA
SCHEMBL2988932 0.85 IKBKB (0.46) IKBKBCHUKIKBKGLMNABRAF
SCHEMBL2980491 0.85 IKBKB (0.36) IKBKBCHUKIKBKGMEN1KMT2A

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 IKBKB 1952/4885CHUK 1311/4885IKBKG 2049/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 IKBKB 1952/4885CHUK 1311/4885IKBKG 2049/4885

“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.