SCHEMBL27435976

SCHEMBL27435976

CNC(=O)c1cccc(N[SH](=O)=O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 1/20 0.56
▸ HDAC6 Q9UBN7 1/20 0.56
▸ ALDH1A1 P00352 3/20 0.45
▸ GRK2 P25098 3/20 0.44
▸ GRK3 P35626 3/20 0.44
▸ ROCK2 O75116 1/20 0.44
▸ KMT2A Q03164 5/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ KCNK3 O14649 1/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ KCNK9 Q9NPC2 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ RAB9A P51151 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ SLC7A5 Q01650 1/20 0.43
▸ MAPK1 P28482 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
SCHEMBL2299458 0.82 HDAC8 (0.63) HDAC8HDAC6ALDH1A1KMT2AMEN1
SCHEMBL15819579 0.80 AKR1C3 (0.57) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL12895630 0.79 HDAC8 (0.56) HDAC8HDAC6ALDH1A1GRK2GRK3
SCHEMBL27464599 0.79 RAB9A (0.59) ALDH1A1KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL5909363 0.79 HDAC8 (0.83) HDAC8HDAC6ALDH1A1KMT2AMEN1
SCHEMBL28617692 0.79 ALDH1A1 (0.43) ALDH1A1KMT2AMEN1KCNK3KCNK9
SCHEMBL13151191 0.79 HDAC8 (0.59) HDAC8HDAC6ALDH1A1KMT2AMEN1
SCHEMBL20888372 0.79 HDAC8 (0.59) HDAC8HDAC6ALDH1A1KMT2AMEN1
SCHEMBL18193498 0.79 HDAC8 (0.59) HDAC8HDAC6ALDH1A1KMT2AMEN1
SCHEMBL26741217 0.79 MEN1 (0.54) KMT2AMEN1

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
CN-1127479-C Sulfonylurea derivatives and their use in the control of interleukin-1 activity PFIZER (US) 2003-11-12 — — CN disclosed
CN-1245490-A Sulfonyl urea derivatives and their use in control of interleukin-1 activity PFIZER (US) 2000-02-23 — — CN disclosed
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