SCHEMBL11048486

SCHEMBL11048486

C=CCS(=O)(=O)NNC(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 6/20 0.54
POLB P06746 1/20 0.50
GAA P10253 3/20 0.48
MAPT P10636 3/20 0.48
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAOA P21397 1/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
PTGS2 P35354 1/20 0.43
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL6393324 0.83 LMNA (0.49) KAT6APOLBGAAMAPTALDH1A1
SCHEMBL29045641 0.78 KAT6A (0.59) KAT6APOLBGAAMAPTMEN1
SCHEMBL3635917 0.74 HPGD (0.46) KAT6AGAAMAPTALDH1A1LMNA
Benzene SCHEMBL28257695 0.73 KAT6A (0.67) KAT6APOLBGAAMEN1KMT2A
SCHEMBL6259861 0.73 KMT2A (0.45) POLBMAPTALDH1A1LMNAHPGD
SCHEMBL11048483 0.73 ALDH1A1 (0.45) POLBGAAMAPTALDH1A1LMNA
SCHEMBL11131714 0.73 IDO1 (0.54) POLBGAAMAPTALDH1A1LMNA
SCHEMBL5473586 0.73 POLB (0.64) POLBGAAMAPTALDH1A1LMNA
SCHEMBL3148896 0.72 KAT6A (0.65) KAT6APOLBGAAMEN1KMT2A
SCHEMBL8744064 0.70 AKT1 (0.45) POLBMAPTALDH1A1LMNAHPGD

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
JP-59020356-A None JP disclosed
JP-S5920356-A MONOAZO COMPOUND AND DYEING METHOD USING SAME GOSEI SENRIYOU GIJUTSU KENKYU KUMIAI 1984-02-02 JP disclosed