SCHEMBL2987755

SCHEMBL2987755

CC1(C)C(=O)NC(=O)N1CCNc1ncc(-c2cccc(N)c2)c(-c2ccc(Cl)s2)n1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 4/20 0.37
ABL1 P00519 6/20 0.35
FGFR1 P11362 3/20 0.31
PTPN11 Q06124 1/20 0.31
EGFR P00533 1/20 0.31
BRAF P15056 1/20 0.31
PDGFRB P09619 1/20 0.31
SRC P12931 1/20 0.31
PDGFRA P16234 1/20 0.31
MAPK14 Q16539 1/20 0.31
BRD4 O60885 1/20 0.31
MAP4K4 O95819 1/20 0.30
MAPK1 P28482 1/20 0.30
BPTF Q12830 1/20 0.30

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
SCHEMBL2981681 0.90 ADORA1 (0.39) ADORA1ABL1FGFR1EGFRBRAF
SCHEMBL2976762 0.90 ADORA1 (0.41) ADORA1ABL1FGFR1PTPN11EGFR
SCHEMBL2981953 0.90 ADORA1 (0.41) ADORA1ABL1FGFR1EGFRPDGFRB
SCHEMBL2985654 0.89 ADORA1 (0.37) ADORA1FGFR1BRD4
SCHEMBL2988796 0.87 TAF1 (0.38) ADORA1
SCHEMBL2988365 0.87 PIK3C3 (0.38) ADORA1ABL1PDGFRBSRCPDGFRA
SCHEMBL5147429 0.86 ADORA1 (0.37) ADORA1ABL1BRAFMAPK1BPTF
SCHEMBL2975251 0.84 ADORA1 (0.35) ADORA1ABL1BRAFPDGFRBSRC
SCHEMBL2980841 0.84 ADORA1 (0.40) ADORA1ABL1FGFR1MAPK1
SCHEMBL2982138 0.83 SYK (0.36)

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 ADORA1 1406/4885ABL1 361/4885FGFR1 1230/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 ADORA1 1406/4885ABL1 361/4885FGFR1 1230/4885

“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.