SCHEMBL8400327

SCHEMBL8400327

Clc1ccc2sc(CNc3cccc(Br)c3)nc2c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
PIM1 P11309 2/20 0.39
PIM2 Q9P1W9 2/20 0.39
PIM3 Q86V86 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
TRPA1 O75762 2/20 0.36
TRPM5 Q9NZQ8 2/20 0.36
AKR1B1 P15121 1/20 0.36
EGFR P00533 5/20 0.35

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
SCHEMBL8399119 0.88 GAA (0.44) MEN1KMT2ANPC1LMNAPOLB
SCHEMBL8398847 0.85 MEN1 (0.41) MEN1KMT2ANPC1LMNAPOLB
SCHEMBL8400423 0.85 MEN1 (0.44) MEN1KMT2ANPC1LMNAPOLB
SCHEMBL8396276 0.84 MEN1 (0.47) MEN1KMT2ANPC1LMNAPOLB
SCHEMBL8400420 0.81 MEN1 (0.38) MEN1KMT2ANPC1LMNAPOLB
SCHEMBL8399152 0.81 ALDH1A1 (0.40) MEN1KMT2ANPC1LMNAPOLB
SCHEMBL8399069 0.81 PIM1 (0.39) MEN1KMT2ANPC1LMNAGAA
SCHEMBL8399417 0.79 MEN1 (0.47) MEN1KMT2ANPC1LMNAPOLB
SCHEMBL8395401 0.78 KMT2A (0.43) MEN1KMT2ANPC1LMNAPOLB
SCHEMBL8398024 0.77 MEN1 (0.44) MEN1KMT2ANPC1LMNAPOLB

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