SCHEMBL8399123

SCHEMBL8399123

CCOC(=O)CCC(=O)N(Cc1nc2ccc(F)c(F)c2s1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.52
L3MBTL1 Q9Y468 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TOP2A P11388 2/20 0.36
AKR1B1 P15121 1/20 0.35
TP53 P04637 1/20 0.35
NAAA Q02083 1/20 0.35
GAA P10253 2/20 0.35
HPGD P15428 1/20 0.35
PARP1 P09874 1/20 0.35
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL8400200 0.92 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1MEN1KMT2ATDP1
SCHEMBL8399176 0.92 SMN1; SMN2 (0.44) SMN1; SMN2L3MBTL1MEN1KMT2ATDP1
SCHEMBL8398960 0.91 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1MEN1KMT2ATDP1
SCHEMBL8396324 0.91 SMN1; SMN2 (0.41) SMN1; SMN2MEN1KMT2ATDP1TP53
SCHEMBL8395601 0.91 SMN1; SMN2 (0.41) SMN1; SMN2KDM4E
SCHEMBL8399273 0.90 SMN1; SMN2 (0.40) SMN1; SMN2L3MBTL1MEN1KMT2ATDP1
SCHEMBL8399267 0.90 SMN1; SMN2 (0.40) SMN1; SMN2GAA
SCHEMBL8399271 0.90 SMN1; SMN2 (0.39) SMN1; SMN2MEN1KMT2ATP53GAA
SCHEMBL8400249 0.90 SMN1; SMN2 (0.39) SMN1; SMN2L3MBTL1MEN1KMT2ATDP1
SCHEMBL8398041 0.89 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1MEN1KMT2ATDP1

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