SCHEMBL9036646

SCHEMBL9036646

CCCCOc1ccc(CN2C(=O)C(CC(=O)O)Sc3ccccc32)cc1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
GSK3B P49841 2/20 0.49
S1PR1 P21453 6/20 0.43
S1PR5 Q9H228 5/20 0.43
S1PR3 Q99500 4/20 0.42
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL9037309 0.98 GSK3B (0.50) POLBGSK3BS1PR1S1PR5S1PR3
SCHEMBL9036104 0.97 GSK3B (0.52) POLBGSK3BS1PR1S1PR5S1PR3
SCHEMBL9035470 0.96 POLB (0.52) POLBGSK3BLMNAMAPT
SCHEMBL9036405 0.92 POLB (0.54) POLBGSK3BTP53MAPT
SCHEMBL9036086 0.89 POLB (0.55) POLBGSK3B
SCHEMBL9034627 0.88 POLB (0.54) POLBGSK3BS1PR1S1PR5S1PR3
SCHEMBL9037232 0.87 POLB (0.51) POLBGSK3BTP53
SCHEMBL9036209 0.86 POLB (0.57) POLBGSK3B
SCHEMBL9037675 0.86 POLB (0.60) POLBGSK3BMAPT
SCHEMBL9037918 0.84 POLB (0.71) POLBGSK3B

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