SCHEMBL2976286

SCHEMBL2976286

CC(=O)Nc1cccc(-c2cnc(NCCN3C(=O)NC(=O)C3(C)C)nc2-c2cc3cc(OCCN(C)C)ccc3s2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.35
EGFR P00533 3/20 0.35
BTK Q06187 3/20 0.35
TTK P33981 2/20 0.35
GAK O14976 1/20 0.35
ERBB2 P04626 1/20 0.35
JAK1 P23458 1/20 0.35
TXK P42681 1/20 0.35
BLK P51451 1/20 0.35
JAK3 P52333 1/20 0.35
ITK Q08881 1/20 0.35
ERBB4 Q15303 1/20 0.35
BRAF P15056 3/20 0.35
RAD52 P43351 2/20 0.34
ADORA2A P29274 1/20 0.33
FYN P06241 2/20 0.33
PTK2 Q05397 1/20 0.33
FGFR1 P11362 1/20 0.33
MAPK8 P45983 1/20 0.33
ROCK2 O75116 1/20 0.33

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
SCHEMBL2984256 0.90 PLK1 (0.34) PLK1EGFRBTKTTKGAK
SCHEMBL2985014 0.83 PLK1 (0.33) PLK1BTKFGFR1CACNA2D1
SCHEMBL2975277 0.81 KDR (0.38) PLK1BRAFMAPK8CACNA2D1
SCHEMBL2988365 0.81 PIK3C3 (0.38) JAK3FYNPTK2PIK3C3MERTK
SCHEMBL2972171 0.79 BRAF (0.35) EGFRBLKBRAFADORA2ACACNA2D1
SCHEMBL2983810 0.76 ADORA1 (0.34) ADORA2AFYNMERTK
SCHEMBL2984535 0.76
SCHEMBL2978018 0.76 HSD17B1 (0.39) EGFRJAK3BRAFFGFR1MAPK8
SCHEMBL2983650 0.76 SRC (0.34) EGFRBTKJAK3FYNPTK2
SCHEMBL2975957 0.75 ADORA1 (0.33) JAK3ADORA2APTK2MERTK

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 5 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
US-20070185133-A1 Aminopyrimidine compounds and methods of use AMGEN, INC. (US) 2007-08-09 US 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 1/4885EGFR 2060/4885BTK 1459/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 PLK1 1/4885EGFR 2060/4885BTK 1459/4885

“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.