SCHEMBL8554523

SCHEMBL8554523

N#Cc1sc(NC(=O)c2ncc(C(F)(F)F)cc2Cl)nc1C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.42
HPGD P15428 1/20 0.42
ALDH1A1 P00352 8/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
GAA P10253 2/20 0.41
LMNA P02545 1/20 0.40
BACE1 P56817 5/20 0.40
APP P05067 2/20 0.40
BACE2 Q9Y5Z0 2/20 0.40
MAPT P10636 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CTSE P14091 1/20 0.39
KCNH2 Q12809 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RAB9A P51151 1/20 0.39
KDM4E B2RXH2 1/20 0.38
SORT1 Q99523 1/20 0.38

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
SCHEMBL8553290 0.76 LRRK2 (0.49) HPGDALDH1A1KMT2AMEN1LMNA
SCHEMBL8556231 0.76 RAB9A (0.51) GLAHPGDALDH1A1KMT2AMEN1
SCHEMBL16991804 0.75 TAS1R3 (0.56) GLAHPGDALDH1A1KMT2AMEN1
SCHEMBL8551449 0.74 GRM4 (0.55) ALDH1A1KMT2AMEN1LMNAMAPT
SCHEMBL8553674 0.74 P2RY1 (0.37) HPGDALDH1A1KMT2AMEN1LMNA
SCHEMBL16761935 0.72 PTGS1 (0.58) GLAHPGDALDH1A1KMT2AMEN1
SCHEMBL12195699 0.71 RIPK1 (0.36) ALDH1A1KMT2AMEN1GAALMNA
SCHEMBL7130142 0.71 FFAR2 (0.37) HPGDALDH1A1KMT2AMEN1LMNA
SCHEMBL8551758 0.70 CASP3 (0.51) HPGDALDH1A1KMT2AMEN1LMNA
SCHEMBL18668549 0.70 ALDH1A1 (0.62) GLAHPGDALDH1A1KMT2AMEN1

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-0566138-B1 Amino thiazole derivatives and their use as fungicides HODOGAYA CHEMICAL CO LTD (JP) 1998-11-18 EP claimed
EP-0566138-A1 Amino thiazole derivatives and their use as fungicides HODOGAYA CHEMICAL CO., LTD. (JP) 1993-10-20 EP claimed
EP-0566138-B1 Amino thiazole derivatives and their use as fungicides HODOGAYA CHEMICAL CO LTD (JP) 1998-11-18 EP disclosed
EP-0566138-A1 Amino thiazole derivatives and their use as fungicides HODOGAYA CHEMICAL CO., LTD. (JP) 1993-10-20 EP disclosed