SCHEMBL5147297

SCHEMBL5147297

CC1(C)NC(=O)N(CCNc2ncc(Br)c(-c3cc4c(s3)C(c3ccccc3)CNC4)n2)C1=O

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.34
LMNA P02545 2/20 0.33
HTT P42858 2/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL2981942 0.88 SLC6A4 (0.31)
SCHEMBL5148347 0.86 ALDH1A1 (0.32) ALDH1A1HTTMAPK1SMN1; SMN2
SCHEMBL5147380 0.80 ALDH1A1 (0.40) ALDH1A1LMNAHTTTSHRMAPK1
SCHEMBL5147377 0.80 ALOX15 (0.34) ALDH1A1LMNAHTTSMN1; SMN2ALOX15
SCHEMBL2976992 0.79 DRD2 (0.32)
SCHEMBL5147364 0.77 ALDH1A1 (0.34) ALDH1A1LMNAHTTTSHRMAPK1
SCHEMBL5179917 0.76 ALDH1A1 (0.40) ALDH1A1LMNAHTTMAPK1SMN1; SMN2
SCHEMBL5149221 0.75 ALDH1A1 (0.39) ALDH1A1LMNAHTTTSHRMAPK1
SCHEMBL5147462 0.75 ALDH1A1 (0.42) ALDH1A1LMNAHTTMAPK1SMN1; SMN2
SCHEMBL5148393 0.75 HTT (0.39) ALDH1A1LMNAHTTTSHRMAPK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1831207-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-09-12 EP claimed
WO-2006066172-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN, INC. (US) 2006-06-22 WO claimed
EP-1831207-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-09-12 EP disclosed
WO-2006066172-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN, INC. (US) 2006-06-22 WO disclosed