SCHEMBL31338705

SCHEMBL31338705

CCN(CC)C(=O)CCc1ccc2c(c1)sc1nc(-c3ccc(C(F)(F)F)cc3)cn12

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
TP53 P04637 5/20 0.49
FLT3 P36888 3/20 0.49
THRB P10828 2/20 0.47
LMNA P02545 4/20 0.47
RXFP1 Q9HBX9 1/20 0.47

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
SCHEMBL31338712 0.85 FLT3 (0.52) MAPTTP53FLT3THRBLMNA
SCHEMBL31338701 0.84 MAPT (0.45) MAPTTP53THRBLMNARXFP1
SCHEMBL31338694 0.82 FLT3 (0.49) MAPTTP53FLT3THRBLMNA
SCHEMBL73960 0.78 FLT3 (0.82) FLT3
SCHEMBL31338679 0.78 LMNA (0.53) MAPTTP53THRBLMNARXFP1
SCHEMBL31338713 0.76 FLT3 (0.46) MAPTTP53FLT3THRBLMNA
SCHEMBL31338693 0.74 LMNA (0.47) MAPTTP53THRBLMNARXFP1
SCHEMBL804976 0.73 LMNA (0.48) MAPTTP53FLT3THRBLMNA
SCHEMBL31338709 0.72 FLT3 (0.52) MAPTTP53FLT3THRBLMNA
SCHEMBL31338688 0.72 APP (0.44) MAPTTP53THRBLMNARXFP1

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-4741401-A1 BENZOTHIAZOIMIDAZOLYL COMPOUND AND USE THEREOF ER Stress Research Institute, Inc. (JP) 2026-05-13 EP disclosed
WO-2025009553-A1 BENZOTHIAZOIMIDAZOLYL COMPOUND AND USE THEREOF 小胞体ストレス研究所株式会社 2025-01-09 WO disclosed