SCHEMBL2977942

SCHEMBL2977942

Cc1cncc(C(=O)Nc2ccc3sc(-c4ccnc(NCCN5C(=O)NC(=O)C5(C)C)n4)cc3c2)c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 8/20 0.39
KDR P35968 6/20 0.39
IKBKB O14920 6/20 0.38
CHUK O15111 5/20 0.38
IKBKG Q9Y6K9 5/20 0.38
MAPK14 Q16539 1/20 0.34
ABL1 P00519 5/20 0.34
PDGFRA P16234 3/20 0.34
BCR P11274 2/20 0.34
KIT P10721 4/20 0.34
ABL2 P42684 3/20 0.34
ACKR3 P25106 1/20 0.34

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
SCHEMBL2990209 0.91 PDGFRB (0.43) PDGFRBKDRIKBKBCHUKIKBKG
SCHEMBL2983547 0.90 IKBKB (0.41) PDGFRBKDRIKBKBCHUKIKBKG
SCHEMBL2984268 0.89 PDGFRB (0.46) PDGFRBKDRIKBKBCHUKIKBKG
SCHEMBL2983663 0.86 IKBKB (0.39) PDGFRBIKBKBCHUKIKBKGABL1
SCHEMBL2986419 0.86 AURKA (0.42) PDGFRBKDRIKBKBCHUKIKBKG
SCHEMBL2987595 0.85 IKBKB (0.41) PDGFRBKDRIKBKBCHUKIKBKG
SCHEMBL2978246 0.85 IKBKB (0.38) PDGFRBKDRIKBKBCHUKIKBKG
SCHEMBL2975941 0.84 IKBKB (0.38) PDGFRBKDRIKBKBCHUKIKBKG
SCHEMBL2983796 0.84 IKBKB (0.38) IKBKBCHUKIKBKG
SCHEMBL27688662 0.84 IKBKB (0.38) PDGFRBKDRIKBKBCHUKIKBKG

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 PDGFRB 1669/4885KDR 2156/4885IKBKB 1952/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 PDGFRB 1669/4885KDR 2156/4885IKBKB 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.