SCHEMBL7396455

SCHEMBL7396455

CCC(=O)NSCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
MAPT P10636 2/20 0.43
GAA P10253 2/20 0.43
KMT2A Q03164 4/20 0.43
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 5/20 0.42
HPGD P15428 2/20 0.42
CYP2C19 P33261 2/20 0.42
TP53 P04637 1/20 0.41
MEN1 O00255 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 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
SCHEMBL3074971 0.86 ALDH1A1 (0.46) LMNAGAAKMT2AALDH1A1HPGD
SCHEMBL7342760 0.84 HPGD (0.47) RAB9ALMNAMAPTALDH1A1HPGD
SCHEMBL28396949 0.81 CYP2C19 (0.44) LMNAKMT2AMTNR1AMTNR1BL3MBTL1
SCHEMBL3080810 0.80 CYP2C19 (0.47) LMNAKMT2AL3MBTL1ALDH1A1HPGD
SCHEMBL7844886 0.80 SMN1; SMN2 (0.47) LMNAMAPTKMT2AL3MBTL1ALDH1A1
SCHEMBL3057987 0.80 IDO1 (0.44) LMNAKMT2AALDH1A1HPGDCYP2C19
SCHEMBL11483000 0.79 KMT2A (0.51) RAB9ALMNAMAPTGAAKMT2A
SCHEMBL28005485 0.78 MEN1 (0.55) RAB9ALMNAGAAKMT2AALDH1A1
SCHEMBL11218025 0.78 SMN1; SMN2 (0.42) RAB9ALMNAKMT2AL3MBTL1ALDH1A1
SCHEMBL10589026 0.77 GAA (0.50) RAB9ALMNAMAPTGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1144368-A2 ACETYLENIC ALPHA-AMINO ACID-BASED SULFONAMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-17 EP claimed
WO-2000044709-A2 ACETYLENIC α-AMINO ACID-BASED SULFONAMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO claimed
EP-1144368-A2 ACETYLENIC ALPHA-AMINO ACID-BASED SULFONAMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-17 EP disclosed
WO-2000044709-A2 ACETYLENIC α-AMINO ACID-BASED SULFONAMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO disclosed