SCHEMBL2975823

SCHEMBL2975823

CSc1ncc(Cl)c(-c2cc(CCN3CCOCC3)c(Cc3ccc(F)cc3)s2)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 5/20 0.41
MAPK13 O15264 4/20 0.41
MAPK12 P53778 4/20 0.41
MAPK11 Q15759 4/20 0.41
CDK1 P06493 1/20 0.39
KDR P35968 1/20 0.39
POLB P06746 2/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 2/20 0.37
RECQL P46063 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
SRC P12931 1/20 0.35
FLT3 P36888 1/20 0.35
GAA P10253 1/20 0.35
EGFR P00533 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PDE4B Q07343 1/20 0.35
MAP4K4 O95819 1/20 0.34
ERBB2 P04626 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
SCHEMBL2974906 0.83 MAPT (0.37) MAPK14MAPK13MAPK12MAPK11CDK1
SCHEMBL17837248 0.59 MAPK1 (0.53) CDK1KDRALDH1A1SIGMAR1SRC
SCHEMBL12943763 0.58 KCNH2 (0.47) POLBMAPTRECQLSIGMAR1
SCHEMBL4918512 0.58 MAPK13 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL16986161 0.58 MAPT (0.54) MAPK14MAPK13MAPK12MAPK11POLB
SCHEMBL19560101 0.58 ACHE (0.44) POLBKDM4EALDH1A1MAPTRECQL
SCHEMBL13109415 0.57 SLC6A4 (0.69) SIGMAR1
SCHEMBL5113611 0.57 MAPK14 (0.47) MAPK14SRCFLT3EGFRTP53
SCHEMBL2984593 0.57 CCNA2 (0.42) MAPK14MAPK13MAPK12MAPK11ALDH1A1
SCHEMBL15987551 0.57 SIGMAR1 (0.60) CDK1KDRPOLBSIGMAR1

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 MAPK14 2182/4885MAPK13 1955/4885MAPK12 1411/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 MAPK14 2182/4885MAPK13 1955/4885MAPK12 1411/4885

“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.