SCHEMBL8396244

SCHEMBL8396244

O=C(O)CCC(=O)N(Cc1nc2c(Cl)c(Cl)ccc2s1)c1ccccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 2/20 0.45
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LMNA P02545 4/20 0.35
MAPT P10636 3/20 0.35
TP53 P04637 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
POLB P06746 2/20 0.34
HTT P42858 2/20 0.34
NPC1 O15118 1/20 0.34
GAA P10253 1/20 0.34
RAB9A P51151 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALOX15 P16050 1/20 0.34
FDFT1 P37268 1/20 0.34
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL8398174 0.91 AKR1B1 (0.43) AKR1B1MEN1KMT2ALMNAMAPT
SCHEMBL8400221 0.91 AKR1B1 (0.43) AKR1B1MEN1KMT2ALMNAMAPT
SCHEMBL8399303 0.91 AKR1B1 (0.43) AKR1B1MEN1KMT2ALMNAMAPT
SCHEMBL8398067 0.89 AKR1B1 (0.46) AKR1B1MEN1KMT2ALMNAMAPT
SCHEMBL8399278 0.88 AKR1B1 (0.41) AKR1B1MEN1KMT2AMAPTHDAC6
SCHEMBL8400252 0.88 AKR1B1 (0.41) AKR1B1MEN1KMT2ALMNAMAPT
SCHEMBL8398955 0.87 SMN1; SMN2 (0.41) AKR1B1MEN1KMT2ALMNAMAPT
SCHEMBL8401608 0.87 AKR1B1 (0.43) AKR1B1LMNAMAPTTP53HDAC6
SCHEMBL8395474 0.84 AKR1B1 (0.41) AKR1B1MEN1KMT2ALMNAMAPT
SCHEMBL8400257 0.84 AKR1B1 (0.38) AKR1B1MEN1KMT2ALMNAMAPT

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