SCHEMBL8398019

SCHEMBL8398019

Fc1ccc2sc(CNc3cccc(Cl)c3)nc2c1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.43
HDAC6 Q9UBN7 2/20 0.43
PIM1 P11309 3/20 0.40
PIM2 Q9P1W9 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ROCK2 O75116 1/20 0.38
GRK2 P25098 1/20 0.38
DHFR P00374 1/20 0.37
SYK P43405 1/20 0.37
TRPA1 O75762 1/20 0.37
TRPM5 Q9NZQ8 1/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ATM Q13315 1/20 0.37
POLB P06746 1/20 0.36
AKR1B1 P15121 1/20 0.36

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
SCHEMBL8395622 0.89 KDM4E (0.41) GAAHDAC6PIM1PIM2MEN1
SCHEMBL8399069 0.86 PIM1 (0.39) GAAPIM1PIM2MEN1KMT2A
SCHEMBL8398085 0.85 AKR1B1 (0.44) GAAPIM1MEN1KMT2AALDH1A1
SCHEMBL8396300 0.84 MEN1 (0.43) HDAC6PIM1MEN1KMT2AALDH1A1
SCHEMBL8397910 0.84 AKR1B1 (0.42) GAAHDAC6MEN1KMT2AAKR1B1
SCHEMBL8399119 0.84 GAA (0.44) GAAHDAC6PIM1PIM2MEN1
SCHEMBL8395768 0.82 MEN1 (0.35) GAAPIM1PIM2MEN1KMT2A
SCHEMBL8398153 0.82 SYK (0.44) PIM1MEN1KMT2AALDH1A1KDM4E
SCHEMBL8398879 0.80 AKR1B1 (0.37) HDAC6PIM1KMT2AALDH1A1KDM4E
SCHEMBL8395544 0.80 GAA (0.43) GAAHDAC6MEN1KMT2AALDH1A1

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