SCHEMBL28947148

SCHEMBL28947148

CC(C(N)=O)N(c1ccc(F)cc1)c1nc(N)c(C(=O)c2cc(C(=O)NC(F)C(F)F)no2)s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
POLB P06746 2/20 0.37
CDK5 Q00535 4/20 0.35
CDK5R1 Q15078 4/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
TP53 P04637 3/20 0.34
NPC1 O15118 3/20 0.33
CCNA2 P20248 3/20 0.33
CDK2 P24941 3/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
CASP1 P29466 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAPK1 P28482 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
SCHEMBL23930609 0.93 MAPT (0.37) MAPTMEN1KMT2APOLBCDK5
SCHEMBL23930498 0.93 MAPT (0.38) MAPTMEN1KMT2APOLBCDK5
SCHEMBL30210848 0.93 MAPT (0.38) MAPTMEN1KMT2APOLBCDK5
SCHEMBL23930488 0.89 MAPT (0.36) MAPTMEN1KMT2APOLBCDK5
SCHEMBL30210925 0.89 MAPT (0.36) MAPTMEN1KMT2APOLBCDK5
SCHEMBL25199172 0.88 SMN1; SMN2 (0.38) MAPTMEN1KMT2APOLBCDK5
SCHEMBL31411943 0.88 SMN1; SMN2 (0.38) MAPTMEN1KMT2APOLBCDK5
SCHEMBL23930462 0.87 NPC1 (0.42) MAPTMEN1KMT2APOLBCDK5
SCHEMBL31633436 0.87 CCNA2 (0.37) MAPTMEN1KMT2APOLBCDK5
SCHEMBL23930595 0.87 CCNA2 (0.37) MAPTMEN1KMT2APOLBCDK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115697979-A Substituted aminothiazoles as DGKZETA inhibitors for immune activation 拜耳公司 2023-02-03 CN claimed