SCHEMBL9035171

SCHEMBL9035171

O=C(O)CC1Sc2ccccc2N(Cc2ccc(Br)cc2)C1=O

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.60
GSK3B P49841 2/20 0.44
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43
CHRM5 P08912 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL9037918 0.91 POLB (0.71) POLBGSK3B
SCHEMBL9037207 0.89 POLB (0.61) POLBGSK3BTP53SMN1; SMN2
SCHEMBL9034916 0.88 POLB (0.60) POLBGSK3BALDH1A1MAPTTP53
SCHEMBL9037675 0.88 POLB (0.60) POLBGSK3BMAPTSMN1; SMN2
SCHEMBL9492521 0.87 POLB (0.53) POLBGSK3BTP53SMN1; SMN2
SCHEMBL9036209 0.86 POLB (0.57) POLBGSK3BSMN1; SMN2
SCHEMBL9035050 0.85 POLB (0.56) POLBGSK3BSMN1; SMN2
SCHEMBL9035893 0.85 GSK3B (0.59) POLBGSK3BALDH1A1MAPTTP53
SCHEMBL9035957 0.85 POLB (0.56) POLBGSK3BTP53SMN1; SMN2
SCHEMBL9035177 0.85 POLB (0.56) POLBGSK3BMAPTSMN1; 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