SCHEMBL5746773

SCHEMBL5746773

O=C(CN1C(=O)C(Cc2ccc(O)cc2)Sc2ccccc21)NO

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
TSHR P16473 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
MAPK1 P28482 1/20 0.50
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL5747365 0.90 SMN1; SMN2 (0.53) SMN1; SMN2TSHRL3MBTL1MAPK1LMNA
SCHEMBL5746821 0.87 LMNA (0.53) SMN1; SMN2TSHRL3MBTL1MAPK1LMNA
SCHEMBL5746559 0.80 PPARG (0.51) PPARGSMN1; SMN2TSHRLMNAHTT
SCHEMBL6846385 0.76 SMN1; SMN2 (0.42) SMN1; SMN2TSHRL3MBTL1MAPK1
SCHEMBL6841912 0.76 RAB9A (0.45) SMN1; SMN2TSHRL3MBTL1MAPK1LMNA
SCHEMBL5745760 0.76 MCL1 (0.46) SMN1; SMN2TSHRLMNA
SCHEMBL13750042 0.75 POLB (0.54) SMN1; SMN2
SCHEMBL13749484 0.75 SMN1; SMN2 (0.52) SMN1; SMN2TSHRL3MBTL1MAPK1LMNA
SCHEMBL12888411 0.75 HTT (0.50) SMN1; SMN2TSHRL3MBTL1MAPK1LMNA
SCHEMBL5747025 0.75 PPARG (0.45) PPARGSMN1; SMN2TSHRLMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1173427-B1 HYDROXAMIC ACID DERIVATIVE DAINIPPON SUMITOMO PHARMA CO (JP) 2006-04-05 EP disclosed
US-6713477-B1 1,4-BENZTHIAZINES OR BENZOXAZINES; MATRIX METALLOPROTEINASE INHIBITORS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-03-30 US disclosed