SCHEMBL8954802

SCHEMBL8954802

CNC(=O)/C(=N/OC)c1ccc(CCc2ccccc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.46
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
MGLL Q99685 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPT P10636 2/20 0.40
FFAR1 O14842 1/20 0.40
PLK1 P53350 1/20 0.40
PLAAT3 P53816 1/20 0.39
PLAAT5 Q96KN8 1/20 0.39
PLAAT2 Q9NWW9 1/20 0.39
PLAAT4 Q9UL19 1/20 0.39
KDM4E B2RXH2 1/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL8368533 1.00 HDAC1 (0.46) HDAC1NPC1RAB9ASMN1; SMN2LMNA
SCHEMBL8819049 0.86 TSHR (0.47) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL563939 0.86 TSHR (0.47) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL8539430 0.86 TSHR (0.47) NPC1RAB9ASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL27494132 0.86 PLK1 (0.40) HDAC1LMNAHDAC8ALDH1A1PLK1
SCHEMBL8954640 0.84 MAOB (0.56) HDAC1NPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL8368529 0.82 HIF1A (0.49) SMN1; SMN2LMNAL3MBTL1ALDH1A1MAPT
SCHEMBL8954797 0.82 HIF1A (0.49) SMN1; SMN2LMNAL3MBTL1ALDH1A1MAPT
SCHEMBL8368526 0.82 HIF1A (0.49) SMN1; SMN2LMNAL3MBTL1ALDH1A1MAPT
SCHEMBL10433737 0.81 KEAP1 (0.45) HDAC1NPC1LMNAALDH1A1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0398692-B1 Alkoxyiminoacetamide derivatives and their use as fungicides SHIONOGI & CO (JP) 1996-08-21 EP disclosed
US-5548078-A FOR AGRICULTURE SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1996-08-20 US disclosed
US-5401877-A Agricultural fungicide SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1995-03-28 US disclosed
EP-0629609-A1 Process for the preparation of Alkoxyiminoacetamide derivatives and an intermediate therefor SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1994-12-21 EP disclosed
US-5371222-A Intermediates SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1994-12-06 US disclosed
US-5371223-A Controlling phytopathogens SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1994-12-06 US disclosed
US-5185342-A ALKOXYIMINOACETAMIDE DERIVATIVES AND THEIR USE AS FUNGICIDES SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1993-02-09 US disclosed
EP-0398692-A2 Alkoxyiminoacetamide derivatives and their use as fungicides SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1990-11-22 EP disclosed