SCHEMBL9035117

SCHEMBL9035117

CCCCCc1ccc2c(c1)N(Cc1ccc(Cl)c(Cl)c1)C(=O)C(CC(=O)O)S2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
GSK3B P49841 1/20 0.39
SIGMAR1 Q99720 3/20 0.37
KMT2A Q03164 1/20 0.37
LIPG Q9Y5X9 1/20 0.36
S1PR1 P21453 2/20 0.36
S1PR3 Q99500 2/20 0.36
S1PR4 O95977 1/20 0.36
S1PR5 Q9H228 1/20 0.36
ALDH1A1 P00352 2/20 0.35
APAF1 O14727 2/20 0.35
UCHL1 P09936 1/20 0.35
UCHL3 P15374 1/20 0.35
ALOX15 P16050 2/20 0.34
IGF1R P08069 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
BCHE P06276 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 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
SCHEMBL9036325 0.99 POLB (0.43) POLBGSK3BSIGMAR1KMT2ALIPG
SCHEMBL9036684 0.97 POLB (0.45) POLBGSK3BSIGMAR1KMT2ALIPG
SCHEMBL9035767 0.93 POLB (0.46) POLBGSK3BSIGMAR1KMT2AALDH1A1
SCHEMBL9035544 0.89 POLB (0.48) POLBKMT2AALDH1A1APAF1UCHL1
SCHEMBL9036091 0.87 POLB (0.41) POLBGSK3BS1PR1S1PR3S1PR5
SCHEMBL9036080 0.87 POLB (0.43) POLBS1PR1S1PR3S1PR5
SCHEMBL9036968 0.86 S1PR5 (0.41) POLBGSK3BS1PR1S1PR3S1PR5
SCHEMBL9037449 0.85 POLB (0.48) POLBKMT2AALDH1A1APAF1UCHL1
SCHEMBL9035230 0.85 POLB (0.50) POLBKMT2AALDH1A1APAF1ALOX15
SCHEMBL9035901 0.84 POLB (0.46) POLBKMT2AALDH1A1APAF1UCHL1

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