SCHEMBL7488353

SCHEMBL7488353

COC(=O)CCC(=O)c1ccc2c(c1)N(C)C(=O)CS2

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.70
SMN1; SMN2 Q16637 2/20 0.70
LMNA P02545 1/20 0.63
MAPT P10636 11/20 0.53
MEN1 O00255 7/20 0.53
KMT2A Q03164 7/20 0.53
MAPK1 P28482 6/20 0.52
ALDH1A1 P00352 4/20 0.52
CLK1 P49759 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HTT P42858 3/20 0.49
OPRM1 P35372 1/20 0.49
OPRD1 P41143 1/20 0.49
ALOX15 P16050 3/20 0.48
USP2 O75604 1/20 0.48
TP53 P04637 1/20 0.48
GAA P10253 1/20 0.46
HSD17B10 Q99714 2/20 0.46
KDM4E B2RXH2 1/20 0.45
CASP1 P29466 1/20 0.45

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
SCHEMBL5422370 0.82 POLB (1.00) POLBSMN1; SMN2LMNAMAPTMEN1
SCHEMBL2636675 0.78 LMNA (1.00) POLBSMN1; SMN2LMNAMAPTMEN1
SCHEMBL5912909 0.78 LMNA (0.78) POLBSMN1; SMN2LMNAMAPTMEN1
SCHEMBL30270516 0.78 LMNA (1.00) POLBSMN1; SMN2LMNAMAPTMEN1
SCHEMBL18618415 0.77 LMNA (0.72) POLBSMN1; SMN2LMNAMAPTMEN1
SCHEMBL24124207 0.77 LMNA (0.76) POLBSMN1; SMN2LMNAMAPTMEN1
SCHEMBL30270575 0.77 LMNA (0.76) POLBSMN1; SMN2LMNAMAPTMEN1
SCHEMBL7343831 0.76 USP30 (0.48) POLBSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL10651410 0.74 LMNA (0.71) POLBSMN1; SMN2LMNAMAPTMEN1
SCHEMBL7412499 0.73 MAPT (0.37) POLBSMN1; SMN2LMNAMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1071427-A 6-Benzoxazinyl and 6-benzothiazine base-2,3,4,5-tetrahydro pyridazine-3-ketone ORTHO PHARMA CORP (US) 1993-04-28 CN disclosed
EP-0509845-A1 (+) and (-) enantiomers of 5-aliphatic-6-(benzoxazinyl- or benzothiazinyl)-2,3,4,5-tetrahydropyridazin-3-ones ORTHO PHARMACEUTICAL CORPORATION (US) 1992-10-21 EP disclosed
US-5081242-A Cardiotonic and bronchodilator agents; phosphodiesterase inhibitors ORTHO PHARMACEUTICAL CORPORATION (US) 1992-01-14 US disclosed
CN-87108354-A 6-benzoxazinyl and 6-benzothiazinyl-2, 3, 4, 5-tetrahydropyridazin-3-ones 1988-09-21 CN disclosed
US-4766118-A CARDIOTONIC AGENTS, PHOSPHODIESTERASE INHIBITORS ORTHO PHARMACEUTICAL CORPORATION (US) 1988-08-23 US disclosed
EP-0272914-A2 6-Benzoxazinyl- and 6-benzothiazinyl-2,3,4,5-tetrahydropyridazin-3-ones ORTHO PHARMACEUTICAL CORPORATION (US) 1988-06-29 EP disclosed