SCHEMBL11227790

SCHEMBL11227790

NC(=NOCC(=O)O)c1cccs1

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.52
NPC1 O15118 6/20 0.52
HPGD P15428 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
PKM P14618 2/20 0.52
KMT2A Q03164 2/20 0.52
NOS1 P29475 1/20 0.49
DAO P14920 1/20 0.46
LMNA P02545 3/20 0.45
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43

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
SCHEMBL9781856 0.85 RAB9A (0.47) RAB9ANPC1HPGDSMN1; SMN2PKM
SCHEMBL1520458 0.81 HPGD (0.69) RAB9ANPC1HPGDSMN1; SMN2PKM
SCHEMBL1520453 0.81 HPGD (0.69) RAB9ANPC1HPGDSMN1; SMN2PKM
SCHEMBL1520457 0.81 HPGD (0.69) RAB9ANPC1HPGDSMN1; SMN2PKM
SCHEMBL9781850 0.79 HPGD (0.46) RAB9ANPC1HPGDSMN1; SMN2PKM
SCHEMBL11538113 0.75 GSK3B (0.53) RAB9ANPC1HPGDSMN1; SMN2PKM
SCHEMBL871924 0.75 NPC1 (0.50) RAB9ANPC1HPGDSMN1; SMN2PKM
SCHEMBL10035168 0.75 NPC1 (0.50) RAB9ANPC1HPGDSMN1; SMN2PKM
SCHEMBL1520245 0.74 SMN1; SMN2 (0.64) RAB9ANPC1HPGDSMN1; SMN2PKM
SCHEMBL1520243 0.74 SMN1; SMN2 (0.64) RAB9ANPC1HPGDSMN1; SMN2PKM

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-4324579-A Herbicidal and phytohormonal amidoximes PHILARGO (FR) 1982-04-13 US disclosed
US-4216006-A Herbicidal and phytohormonal amidoximes PHILAGRO (FR) 1980-08-05 US disclosed
US-4116974-A HERBICIDAL AND PHYTOHORMONAL AMIDOXIMES PHILAGRO (FR) 1978-09-26 US disclosed