SCHEMBL2973156

SCHEMBL2973156

CC1(C)C(=O)NC(=O)N1CCNc1ncc(Cl)c(-c2cc(CCN3CCOCC3)c(Cc3ccc(F)cc3)s2)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 3/20 0.40
KDR P35968 3/20 0.40
CXCR4 P61073 1/20 0.37
MAPK8 P45983 1/20 0.36
FGFR1 P11362 1/20 0.35
SRC P12931 1/20 0.35
FGFR2 P21802 1/20 0.35
FGFR4 P22455 1/20 0.35
FGFR3 P22607 1/20 0.35
CCNT1 O60563 1/20 0.35
MAPK1 P28482 3/20 0.34
HTR2A P28223 1/20 0.34
AXL P30530 1/20 0.34
CNR2 P34972 1/20 0.33
PIK3CA P42336 1/20 0.33
MTOR P42345 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
MAPK3 P27361 1/20 0.33
FYN P06241 1/20 0.33
POLB P06746 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
SCHEMBL2981974 0.87 CDK1 (0.31) CDK1KDRHTR2AAXL
SCHEMBL2980449 0.86 IKBKB (0.32) CDK1KDRHTR2AAXL
SCHEMBL2975963 0.86 MAPK8 (0.34) CDK1KDRMAPK8HTR2AAXL
SCHEMBL2972072 0.86 CA1 (0.34) CCNT1HTR2A
SCHEMBL5166562 0.83
SCHEMBL2981950 0.82 MAPK1 (0.33) MAPK1AXL
SCHEMBL13685047 0.81
SCHEMBL2980503 0.81
SCHEMBL2971299 0.79
SCHEMBL2975823 0.78 MAPK14 (0.41) CDK1KDRSRCSIGMAR1POLB

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 10 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 claimed
US-7786132-B2 Aminopyrimidine compounds and methods of use AMGEN INC. (US) 2010-08-31 US claimed
US-20070185133-A1 Aminopyrimidine compounds and methods of use AMGEN, INC. (US) 2007-08-09 US claimed
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 CDK1 10/4885KDR 2156/4885CXCR4 3026/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 CDK1 10/4885KDR 2156/4885CXCR4 3026/4885

“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.