SCHEMBL8399202

SCHEMBL8399202

CCOC(=O)CCC(=O)N(Cc1nc2c(F)c(F)ccc2s1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.52
AKR1B1 P15121 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
GAA P10253 2/20 0.35
LMNA P02545 1/20 0.35
NPC1 O15118 1/20 0.35
PKM P14618 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 1/20 0.35
TP53 P04637 2/20 0.35
HPGD P15428 1/20 0.35
PARP1 P09874 1/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 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
SCHEMBL8397851 0.92 SMN1; SMN2 (0.44) SMN1; SMN2AKR1B1L3MBTL1MEN1KMT2A
SCHEMBL8395772 0.92 SMN1; SMN2 (0.41) SMN1; SMN2AKR1B1L3MBTL1MEN1KMT2A
SCHEMBL8398980 0.91 SMN1; SMN2 (0.41) SMN1; SMN2AKR1B1L3MBTL1MEN1KMT2A
SCHEMBL8395834 0.91 SMN1; SMN2 (0.41) SMN1; SMN2AKR1B1MEN1KMT2ALMNA
SCHEMBL8398979 0.91 SMN1; SMN2 (0.41) SMN1; SMN2AKR1B1MEN1KMT2ALMNA
SCHEMBL8399027 0.90 SMN1; SMN2 (0.40) SMN1; SMN2AKR1B1L3MBTL1MEN1KMT2A
SCHEMBL8396237 0.90 SMN1; SMN2 (0.40) SMN1; SMN2AKR1B1GAANPC1MAPT
SCHEMBL8395487 0.90 SMN1; SMN2 (0.39) SMN1; SMN2AKR1B1MEN1KMT2AGAA
SCHEMBL8396366 0.90 SMN1; SMN2 (0.39) SMN1; SMN2AKR1B1L3MBTL1MEN1KMT2A
SCHEMBL8401799 0.89 SMN1; SMN2 (0.41) SMN1; SMN2AKR1B1L3MBTL1MEN1KMT2A

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