SCHEMBL6841912

SCHEMBL6841912

CC(=O)Nc1ccc2c(c1)SC(Cc1ccccc1)C(=O)N2CC(=O)NO

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
TSHR P16473 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPK1 P28482 1/20 0.43
THRB P10828 1/20 0.42
POLB P06746 1/20 0.41
ALOX15 P16050 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40

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
Hydroxyamine SCHEMBL5794953 0.89 RAB9A (0.43) RAB9ASMN1; SMN2TSHRL3MBTL1MAPK1
SCHEMBL6847542 0.80 BMP1 (0.40) TSHRLMNAHTT
SCHEMBL5747365 0.77 SMN1; SMN2 (0.53) SMN1; SMN2TSHRL3MBTL1MAPK1LMNA
SCHEMBL5746773 0.76 PPARG (0.52) SMN1; SMN2TSHRL3MBTL1MAPK1LMNA
SCHEMBL5746821 0.75 LMNA (0.53) SMN1; SMN2TSHRL3MBTL1MAPK1LMNA
SCHEMBL5745179 0.74 THRB (0.47) TSHRL3MBTL1THRBLMNAHTT
SCHEMBL5747698 0.74 PPARG (0.45) SMN1; SMN2THRBLMNAHTT
SCHEMBL6847480 0.73 PPARG (0.54) SMN1; SMN2TSHRL3MBTL1MAPK1LMNA
SCHEMBL5745760 0.70 MCL1 (0.46) SMN1; SMN2TSHRTHRBLMNA
SCHEMBL5745464 0.70 GAA (0.41) SMN1; SMN2TSHRL3MBTL1MAPK1POLB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6713477-B1 1,4-BENZTHIAZINES OR BENZOXAZINES; MATRIX METALLOPROTEINASE INHIBITORS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-03-30 US disclosed