SCHEMBL19436409

SCHEMBL19436409

COC(=O)c1sc(C(=O)OC)c2sc(F)cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.43
LMNA P02545 2/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 6/20 0.41
KDM4E B2RXH2 6/20 0.41
ALDH1A1 P00352 5/20 0.41
HSD17B10 Q99714 4/20 0.41
HPGD P15428 4/20 0.41
KMT2A Q03164 2/20 0.41
ALOX15 P16050 2/20 0.41
GLA P06280 2/20 0.41
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.41
ATM Q13315 1/20 0.41
TSHR P16473 2/20 0.40
MAPK14 Q16539 1/20 0.37
NPC1 O15118 2/20 0.37
CASP3 P42574 1/20 0.37
RAB9A P51151 1/20 0.37
SENP8 Q96LD8 1/20 0.37

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
SCHEMBL19439587 0.81 CSNK2A2 (0.46) LMNAMAPK1MAPTKDM4EALDH1A1
SCHEMBL19439632 0.79 MAPT (0.40) IKBKBLMNAMAPK1MAPTKDM4E
SCHEMBL19439591 0.77 MAPT (0.41) LMNAMAPK1MAPTKDM4EALDH1A1
SCHEMBL21152503 0.73 MAPT (0.44) IKBKBLMNAMAPK1MAPTKDM4E
SCHEMBL21152317 0.68 IKBKB (0.42) IKBKBMAPTKDM4EALDH1A1HSD17B10
SCHEMBL21152318 0.68 IKBKB (0.42) IKBKBLMNAMAPK1MAPTKDM4E
SCHEMBL23532121 0.65 MEN1 (0.50) IKBKBLMNAMAPK1MAPTKDM4E
SCHEMBL31078753 0.65 LMNA (0.48) IKBKBLMNAMAPK1MAPTKDM4E
SCHEMBL4654000 0.65 BCKDK (0.50) IKBKBLMNAMAPK1MAPTKDM4E
SCHEMBL28174495 0.65 LMNA (0.63) IKBKBLMNAMAPK1MAPTKDM4E

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
WO-2017167638-A1 NON-AQUEOUS ELECTROLYTES AND USES THEREOF SONY CORPORATION (JP) 2017-10-05 WO disclosed
WO-2017167638-A1 NON-AQUEOUS ELECTROLYTES AND USES THEREOF SONY CORPORATION (JP) 2017-10-05 WO disclosed