SCHEMBL5145975

SCHEMBL5145975

CC(C)N(C)CCOc1ccc2sc(-c3nc(NCCN4C(=O)NC(C)(C)C4=O)ncc3Br)cc2c1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.37
LMNA P02545 5/20 0.36
ALDH1A1 P00352 7/20 0.36
SMN1; SMN2 Q16637 6/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 2/20 0.35
HSD17B10 Q99714 1/20 0.34
PLA2G7 Q13093 1/20 0.34
HTT P42858 3/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
USP2 O75604 1/20 0.32

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
SCHEMBL5148348 0.93 GAA (0.37) ALOX15LMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL5147449 0.90 GAA (0.38) ALOX15LMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL5149190 0.89 ALOX15 (0.38) ALOX15LMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL5147318 0.88 GAA (0.40) ALOX15LMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL2984535 0.88
SCHEMBL5148335 0.87 PDE3B (0.36) ALOX15LMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL5147425 0.84 AURKB (0.38) ALOX15LMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL5147313 0.82 ALDH1A1 (0.35) LMNAALDH1A1SMN1; SMN2MAPTPLA2G7
SCHEMBL5147498 0.81 ALDH1A1 (0.36) ALOX15LMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL5147380 0.81 ALDH1A1 (0.40) LMNAALDH1A1SMN1; SMN2MAPTGAA

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