SCHEMBL2972242

SCHEMBL2972242

CC1(C)C(=O)NC(=O)N1CCNc1ncc(F)c(-c2ncc(Cc3ccc(F)cc3)s2)n1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.33
USP2 O75604 10/20 0.33
CASP1 P29466 10/20 0.33
CASP7 P55210 10/20 0.33
HIF1A Q16665 10/20 0.33
CYP1A2 P05177 9/20 0.33
HSD17B10 Q99714 9/20 0.33
MEN1 O00255 7/20 0.33
KMT2A Q03164 7/20 0.33
TSHR P16473 7/20 0.33
LMNA P02545 6/20 0.33
GLA P06280 4/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 2/20 0.33
ALOX15 P16050 2/20 0.33
GAA P10253 1/20 0.33
OPRK1 P41145 1/20 0.33
CCR6 P51684 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 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
SCHEMBL2975981 0.92 ALDH1A1 (0.33) ALDH1A1USP2CASP1CASP7HIF1A
SCHEMBL13685201 0.87 CXCR4 (0.34) ALDH1A1USP2CASP1CASP7HIF1A
SCHEMBL5149162 0.85 PLA2G7 (0.40) ALDH1A1USP2CASP1CASP7HIF1A
SCHEMBL2977258 0.83 MEN1 (0.33) ALDH1A1USP2CASP1CASP7HIF1A
SCHEMBL5147397 0.80 CXCR4 (0.34) ALDH1A1USP2CASP1CASP7HIF1A
SCHEMBL2980191 0.78 JAK2 (0.33) ALDH1A1USP2CASP1CASP7HIF1A
SCHEMBL5147316 0.77 PLA2G7 (0.39) ALDH1A1USP2CASP1CASP7HIF1A
SCHEMBL27708082 0.77 KDM4E (0.33) ALDH1A1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL2977483 0.76 MEN1 (0.31) ALDH1A1USP2CASP1CASP7HIF1A
SCHEMBL5147385 0.76 MAPK1 (0.35) ALDH1A1USP2CASP1CASP7HIF1A

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 12 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
EP-1831207-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-09-12 EP claimed
US-20070185133-A1 Aminopyrimidine compounds and methods of use AMGEN, INC. (US) 2007-08-09 US claimed
WO-2006066172-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN, INC. (US) 2006-06-22 WO 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 ALDH1A1 1565/4885USP2 3167/4885CASP1 2189/4885
US-20070185133-A1 Aminopyrimidine compounds and methods of use PLK1, TYMP, TK2 ALDH1A1 1565/4885USP2 3167/4885CASP1 2189/4885

“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.