SCHEMBL9681155

SCHEMBL9681155

N#CC(NC(=O)c1cccnc1)c1ccoc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
HDAC1 Q13547 2/20 0.44
HDAC6 Q9UBN7 1/20 0.44
LMNA P02545 3/20 0.42
HIF1A Q16665 1/20 0.42
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ECE1 P42892 1/20 0.41
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
EPHX2 P34913 2/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP3A4 P08684 2/20 0.39
RORC P51449 1/20 0.39
GAA P10253 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
SCHEMBL10719844 0.80 HDAC1 (0.47) THRBHDAC1HDAC6LMNAHIF1A
SCHEMBL7678624 0.77 AGTR1 (0.46) HDAC1HDAC6RAB9AROCK2EPHX2
SCHEMBL10593276 0.74 ALDH1A1 (0.54) THRBHDAC1HDAC6LMNAHIF1A
SCHEMBL10645039 0.73 HDAC1 (0.54) THRBHDAC1HDAC6LMNAHIF1A
SCHEMBL9681833 0.72 ALDH1A1 (0.43) LMNAHIF1ASMN1; SMN2CYP2C19MEN1
SCHEMBL3616505 0.72 HDAC1 (0.56) THRBHDAC1HDAC6LMNAHIF1A
SCHEMBL8802116 0.69 RAB9A (0.42) LMNARAB9ANPC1TP53SMN1; SMN2
SCHEMBL10702217 0.68 RAB9A (0.50) HDAC1HDAC6LMNAHIF1ARAB9A
SCHEMBL10525208 0.68 HDAC1 (0.48) THRBHDAC1HDAC6LMNAHIF1A
SCHEMBL10525214 0.68 HDAC1 (0.48) THRBHDAC1HDAC6LMNAHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5126362-A Substituted pyrazoylacetamides NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1992-06-30 US disclosed
EP-0361362-A1 Oxime derivative and fungicide for agricultural and horticultural use NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1990-04-04 EP disclosed