SCHEMBL9511330

SCHEMBL9511330

CC(=O)OCC(=O)Nc1cccc(N2CCCCC2)c1C#N

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 4/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
LMNA P02545 2/20 0.51
TSHR P16473 2/20 0.51
MAPT P10636 4/20 0.50
POLB P06746 3/20 0.50
MAPK1 P28482 3/20 0.50
ATM Q13315 2/20 0.50
ALDH1A1 P00352 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
USP2 O75604 1/20 0.50
ALOX15 P16050 1/20 0.50
GAA P10253 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.47
NPC1 O15118 1/20 0.47
MMP1 P03956 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
SCHEMBL9511582 0.89 ALDH1A1 (0.56) NPSR1L3MBTL1LMNATSHRMAPT
SCHEMBL9510280 0.83 ALDH1A1 (0.56) NPSR1L3MBTL1LMNATSHRMAPT
SCHEMBL9510386 0.83 SMN1; SMN2 (0.61) TSHRMAPTPOLBALDH1A1USP2
SCHEMBL11485703 0.80 L3MBTL1 (0.55) NPSR1L3MBTL1LMNATSHRMAPT
SCHEMBL11485068 0.79 ALDH1A1 (0.56) NPSR1L3MBTL1LMNAMAPTPOLB
SCHEMBL9510256 0.78 SMN1; SMN2 (0.56) TSHRMAPTPOLBALDH1A1USP2
SCHEMBL9510325 0.77 SMN1; SMN2 (0.55) L3MBTL1LMNAMAPTPOLBALDH1A1
SCHEMBL9510328 0.76 SMN1; SMN2 (0.53) TSHRMAPTPOLBALDH1A1USP2
SCHEMBL9510267 0.76 SMN1; SMN2 (0.54) TSHRPOLBALDH1A1MEN1KMT2A
SCHEMBL11632345 0.76 ALDH1A1 (0.51) NPSR1L3MBTL1LMNATSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0382216-B1 Novel substituted acetamide compounds TOYO BOSEKI (JP) 1993-10-20 EP claimed
EP-0382216-A1 Novel substituted acetamide compounds Toyo Boseki Kabushiki Kaisha (JP) 1990-08-16 EP claimed
EP-0382216-B1 Novel substituted acetamide compounds TOYO BOSEKI (JP) 1993-10-20 EP disclosed
US-5041462-A Novel substituted acetamide compounds and use as anti-allergic agents TOYO BOSEKI KABUSHIKI KAISHA (JP) 1991-08-20 US disclosed
EP-0382216-A1 Novel substituted acetamide compounds Toyo Boseki Kabushiki Kaisha (JP) 1990-08-16 EP disclosed