SCHEMBL8548820

SCHEMBL8548820

OCCN(CCO)CCOc1ccc2nc(Sc3ccc(Cl)cc3)sc2c1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
CTSD P07339 13/20 0.46
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
AURKB Q96GD4 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA4 P22748 1/20 0.41

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
SCHEMBL8357715 0.94 LMNA (0.52) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL8358172 0.88 LMNA (0.59) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL8361572 0.85 KMT2A (0.50) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL8361573 0.83 LMNA (0.53) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL8361495 0.83 LMNA (0.53) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL8356666 0.83 KMT2A (0.48) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL8357707 0.81 MAPT (0.51) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL8356256 0.80 KMT2A (0.65) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL8359497 0.80 MAPT (0.48) MAPTKMT2AMEN1NPC1CTSD
SCHEMBL8357950 0.79 LMNA (0.60) MAPTKMT2AMEN1NPC1CTSD

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-0824529-A1 BENZOTHIAZOLES AND BENZOXAZOLES, AS WELL AS DRUGS CONTAINING THEM, THEIR USE AND METHODS OF PREPARING THEM Dr. Karl Thomae GmbH (DE) 1998-02-25 EP disclosed
WO-1996035681-A1 BENZOTHIAZOLES AND BENZOXAZOLES, AS WELL AS DRUGS CONTAINING THEM, THEIR USE AND METHODS OF PREPARING THEM DR. KARL THOMAE GMBH (DE) 1996-11-14 WO disclosed