SCHEMBL9037176

SCHEMBL9037176

COc1ccc(CN2C(=S)C(CC(=O)O)Sc3ccccc32)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.56
TP53 P04637 1/20 0.50
THRB P10828 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HDAC9 Q9UKV0 1/20 0.46
HDAC5 Q9UQL6 1/20 0.46
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.43
EP300 Q09472 1/20 0.43
CREBBP Q92793 1/20 0.43
KAT2A Q92830 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
SCHEMBL9035893 0.89 GSK3B (0.59) GSK3BTP53THRBSMN1; SMN2HDAC3
SCHEMBL9492706 0.88 POLB (0.56) GSK3BTP53SMN1; SMN2HDAC3HDAC4
SCHEMBL9056739 0.87 POLB (0.47) GSK3BTP53SMN1; SMN2HDAC3HDAC4
SCHEMBL9494225 0.82 POLB (0.44) GSK3BTP53SMN1; SMN2HDAC3HDAC4
SCHEMBL9494708 0.81 CCR2 (0.45) GSK3BTP53HDAC3HDAC4HDAC1
SCHEMBL9493439 0.79 GSK3B (0.55) GSK3BTP53THRBSMN1; SMN2HDAC3
SCHEMBL9036405 0.78 POLB (0.54) GSK3BTP53THRBSMN1; SMN2POLB
SCHEMBL9035442 0.78 POLB (0.53) GSK3BTP53THRBSMN1; SMN2POLB
SCHEMBL9035003 0.78 POLB (0.53) GSK3BTP53THRBSMN1; SMN2HDAC2
SCHEMBL9036646 0.77 POLB (0.52) GSK3BTP53POLBMAPTLMNA

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