SCHEMBL9795934

SCHEMBL9795934

CC(=NNC(=O)O)c1ccc(C)nc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.56
▸ MAPT P10636 3/20 0.56
▸ NPC1 O15118 3/20 0.56
▸ HDAC1 Q13547 1/20 0.53
▸ HDAC6 Q9UBN7 1/20 0.53
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ RAB9A P51151 4/20 0.47
▸ POLB P06746 1/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ ATM Q13315 1/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ LMNA P02545 1/20 0.44

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
SCHEMBL9795932 1.00 ALDH1A1 (0.56) ALDH1A1MAPTNPC1HDAC1HDAC6
SCHEMBL10801436 0.81 L3MBTL1 (0.54) ALDH1A1MAPTNPC1HDAC1HDAC6
SCHEMBL20583292 0.79 GAA (0.71) ALDH1A1NPC1SMN1; SMN2RAB9AKMT2A
SCHEMBL9795959 0.79 GAA (0.71) ALDH1A1NPC1SMN1; SMN2RAB9AKMT2A
SCHEMBL9795955 0.79 GAA (0.71) ALDH1A1NPC1SMN1; SMN2RAB9AKMT2A
SCHEMBL20582091 0.78 MAPT (0.43) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A
SCHEMBL14938560 0.74 MAPT (0.78) ALDH1A1MAPTNPC1SMN1; SMN2RAB9A
SCHEMBL19779264 0.74 HDAC1 (0.48) ALDH1A1MAPTNPC1HDAC1HDAC6
SCHEMBL31290288 0.74 HDAC1 (0.62) ALDH1A1MAPTNPC1HDAC1HDAC6
SCHEMBL181465 0.74 HDAC1 (0.62) ALDH1A1MAPTHDAC1HDAC6SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5023334-A Anthelmintic pyridinyl acylhydrazones THE UPJOHN COMPANY (US) 1991-06-11 — — US claimed
EP-0214158-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1987-03-18 — — EP claimed
WO-1986004582-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1986-08-14 — — WO claimed
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