SCHEMBL5147401

SCHEMBL5147401

CN(c1ccc(F)cc1)c1ncc(-c2nc(NCCN3C(=O)NC(C)(C)C3=O)ncc2F)s1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 1/20 0.39
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
GLA P06280 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
CASP1 P29466 1/20 0.30
CASP7 P55210 1/20 0.30
KMT2A Q03164 1/20 0.30
HIF1A Q16665 1/20 0.30
HSD17B10 Q99714 1/20 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
SCHEMBL5148970 0.93 ALDH1A1 (0.34) PLA2G7ALDH1A1KDM4ELMNATSHR
SCHEMBL5147424 0.87 PLA2G7 (0.35) PLA2G7ALDH1A1
SCHEMBL2977483 0.86 MEN1 (0.31) ALDH1A1MEN1USP2LMNACYP1A2
SCHEMBL5146036 0.84 HTT (0.35) ALDH1A1MEN1LMNATSHRKMT2A
SCHEMBL5181907 0.83 PLA2G7 (0.42) PLA2G7ALDH1A1
SCHEMBL5147391 0.82 PLA2G7 (0.38) PLA2G7ALDH1A1KDM4EMEN1USP2
SCHEMBL2983807 0.79
SCHEMBL5149162 0.77 PLA2G7 (0.40) PLA2G7ALDH1A1KDM4EMEN1USP2
SCHEMBL27708086 0.77 NMT2 (0.31)
SCHEMBL5148346 0.75 PLA2G7 (0.41) PLA2G7ALDH1A1MEN1KMT2A

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