SCHEMBL2984256

SCHEMBL2984256

CN(C)CCOc1ccc2sc(-c3nc(NCCN4C(=O)NC(=O)C4(C)C)ncc3-c3cccc(O)c3)cc2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
FGFR1 P11362 2/20 0.33
CACNA2D1 P54289 1/20 0.33
BTK Q06187 5/20 0.33
LYN P07948 2/20 0.33
SRC P12931 2/20 0.33
KDR P35968 2/20 0.32
ADORA1 P30542 3/20 0.32
ADORA2A P29274 2/20 0.32
EGFR P00533 3/20 0.32
GAK O14976 1/20 0.32
ERBB2 P04626 1/20 0.32
JAK1 P23458 1/20 0.32
TTK P33981 1/20 0.32
TXK P42681 1/20 0.32
BLK P51451 1/20 0.32
JAK3 P52333 1/20 0.32
ITK Q08881 1/20 0.32

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
SCHEMBL2976286 0.90 PLK1 (0.35) PLK1FGFR1CACNA2D1BTKADORA2A
SCHEMBL2975277 0.90 KDR (0.38) PLK1CACNA2D1KDRADORA1RAF1
SCHEMBL2978018 0.86 HSD17B1 (0.39) FGFR1ADORA1EGFRJAK3RAF1
SCHEMBL2985014 0.85 PLK1 (0.33) PLK1FGFR1CACNA2D1BTKLYN
SCHEMBL2972000 0.84 RAF1 (0.35) PLK1FGFR1KDRADORA1ADORA2A
SCHEMBL2972171 0.82 BRAF (0.35) CACNA2D1ADORA1ADORA2AEGFRBLK
SCHEMBL2980178 0.80 HSD17B1 (0.40) PLK1FGFR1KDRADORA1EGFR
SCHEMBL2973501 0.80 ADORA1 (0.39) FGFR1SRCADORA1EGFRRAF1
SCHEMBL2984465 0.79 ADORA1 (0.39) PLK1FGFR1KDRADORA1EGFR
SCHEMBL2981681 0.79 ADORA1 (0.39) FGFR1ADORA1EGFRRAF1BRAF

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 PLK1 1/4885CHRNB2 4850/4885CHRNA4 4876/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 PLK1 1/4885CHRNB2 4850/4885CHRNA4 4876/4885

“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.