SCHEMBL8400260

SCHEMBL8400260

CCCSc1ccc(NCc2nc3c(Cl)c(Cl)ccc3s2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALOX5 P09917 1/20 0.35
EPHX2 P34913 1/20 0.35
HDAC6 Q9UBN7 1/20 0.34
AKR1B1 P15121 1/20 0.32
TRPM5 Q9NZQ8 4/20 0.32
TRPA1 O75762 2/20 0.32
P2RX3 P56373 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL8395582 0.82 MAPT (0.39) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL8395362 0.82 AKR1B1 (0.32) MEN1KMT2ASMN1; SMN2HDAC6AKR1B1
SCHEMBL8398024 0.82 MEN1 (0.44) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL8399417 0.81 MEN1 (0.47) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL8395651 0.80 HDAC6 (0.52) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL8395413 0.79 NPC1 (0.44) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL8400423 0.79 MEN1 (0.44) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL8396276 0.79 MEN1 (0.47) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL8400420 0.74 MEN1 (0.38) MEN1KMT2ANPC1RAB9ALMNA
SCHEMBL8399119 0.72 GAA (0.44) MEN1KMT2ANPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0647636-B1 BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF SENJU PHARMA CO (JP) 1999-06-09 EP disclosed
US-5532257-A ENZYME INHIBITOR SENJU PHARMACEUTICAL CO., LTD (JP) 1996-07-02 US disclosed
EP-0647636-A1 BENZOTHIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Senju Pharmaceutical Co., Ltd. (JP) 1995-04-12 EP disclosed