SCHEMBL9036209

SCHEMBL9036209

CCCc1ccc(CN2C(=O)C(CC(=O)O)Sc3ccccc32)cc1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.57
GSK3B P49841 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.44
TSHR P16473 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPK1 P28482 1/20 0.43
HDAC3 O15379 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL9036086 0.93 POLB (0.55) POLBGSK3BSMN1; SMN2TSHRL3MBTL1
SCHEMBL9034627 0.92 POLB (0.54) POLBGSK3BSMN1; SMN2TSHRL3MBTL1
SCHEMBL9035584 0.91 GSK3B (0.55) POLBGSK3B
SCHEMBL9037675 0.91 POLB (0.60) POLBGSK3BSMN1; SMN2TSHRL3MBTL1
SCHEMBL9037918 0.89 POLB (0.71) POLBGSK3B
SCHEMBL9034916 0.88 POLB (0.60) POLBGSK3BSMN1; SMN2
SCHEMBL9037207 0.87 POLB (0.61) POLBGSK3BSMN1; SMN2HDAC3HDAC6
SCHEMBL9035470 0.86 POLB (0.52) POLBGSK3BSMN1; SMN2L3MBTL1
SCHEMBL9036646 0.86 POLB (0.52) POLBGSK3B
SCHEMBL9035171 0.86 POLB (0.60) POLBGSK3BSMN1; SMN2

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-0492667-B1 1,4-Benzothiazine-2-acetic acid derivatives, processes for production thereof and their use GREEN CROSS CORP (JP) 1996-04-17 EP disclosed
US-5252571-A 1,4-benzothiazine-2-acetic acid derivatives SAPPORO BREWERIES LIMITED (JP) 1993-10-12 US disclosed
EP-0492667-A1 1,4-Benzothiazine-2-acetic acid derivatives, processes for production thereof and their use THE GREEN CROSS CORPORATION (JP) 1992-07-01 EP disclosed