SCHEMBL5149183

SCHEMBL5149183

CC(C)N1CCc2sc(-c3nc(NCCN4C(=O)NC(C)(C)C4=O)ncc3Br)cc2C1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.32
HTT P42858 1/20 0.32
MAPT P10636 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
ALOX15 P16050 1/20 0.31
LMNA P02545 2/20 0.30

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
SCHEMBL2986137 0.87
SCHEMBL5147377 0.84 ALOX15 (0.34) ALDH1A1HTTMAPTSMN1; SMN2ALOX15
SCHEMBL5148347 0.81 ALDH1A1 (0.32) ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL5179917 0.78 ALDH1A1 (0.40) ALDH1A1HTTMAPTSMN1; SMN2LMNA
SCHEMBL5147462 0.77 ALDH1A1 (0.42) ALDH1A1HTTMAPTSMN1; SMN2LMNA
SCHEMBL5147380 0.76 ALDH1A1 (0.40) ALDH1A1HTTMAPTSMN1; SMN2LMNA
SCHEMBL5147364 0.75 ALDH1A1 (0.34) ALDH1A1HTTMAPTSMN1; SMN2ALOX15
SCHEMBL5146079 0.75 ALDH1A1 (0.38) ALDH1A1HTTMAPTSMN1; SMN2LMNA
SCHEMBL5147360 0.75 CYP2A6 (0.35) ALDH1A1HTTMAPTSMN1; SMN2
SCHEMBL5145889 0.75 ALDH1A1 (0.35) ALDH1A1HTTMAPTSMN1; SMN2ALOX15

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 2 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 disclosed
WO-2006066172-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN, INC. (US) 2006-06-22 WO disclosed