SCHEMBL9834169

SCHEMBL9834169

O=C1Cc2ccc(C(=O)c3ccsc3)cc2N1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SMYD3 Q9H7B4 3/20 0.49
▸ CRBN Q96SW2 2/20 0.48
▸ AHR P35869 3/20 0.45
▸ CMA1 P23946 2/20 0.45
▸ EIF2AK2 P19525 1/20 0.44
▸ HDAC6 Q9UBN7 1/20 0.41
▸ TDP2 O95551 4/20 0.40
▸ PDK2 Q15119 1/20 0.39
▸ HSD11B1 P28845 2/20 0.39
▸ PKM P14618 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ CES2 O00748 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ MGLL Q99685 1/20 0.38

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
SCHEMBL9837319 0.89 SMYD3 (0.49) SMYD3AHR
SCHEMBL3573876 0.80 SMYD3 (0.56) SMYD3CRBNAHRCMA1EIF2AK2
SCHEMBL7679044 0.80 SMYD3 (0.53) SMYD3CRBNAHRCMA1EIF2AK2
SCHEMBL3573881 0.78 SMYD3 (0.55) SMYD3CRBNAHRCMA1EIF2AK2
SCHEMBL9836061 0.78 SMYD3 (0.49) SMYD3CRBNAHRCMA1EIF2AK2
SCHEMBL9836325 0.77 CES2 (0.39) SMYD3CRBNPKML3MBTL1CES2
SCHEMBL3581639 0.76 TDP2 (0.55) SMYD3CRBNAHRCMA1EIF2AK2
SCHEMBL3194345 0.76 SMYD3 (0.58) SMYD3CRBNAHRCMA1EIF2AK2
SCHEMBL29713338 0.76 TDP2 (0.66) SMYD3CRBNAHRCMA1EIF2AK2
SCHEMBL398818 0.76 TDP2 (0.66) SMYD3CRBNAHRCMA1EIF2AK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0208510-B1 1-SUBSTITUTED OXINDOLE-3-CARBOXAMINES AS ANTIINFLAMMATORY AND ANALGESIC AGENTS PFIZER INC. (US) 1991-09-11 — — EP disclosed
US-4791129-A RHEUMATIC DISEASES; ANTIARTHRITIC AGENTS PFIZER INC. (US) 1988-12-13 — — US disclosed
US-4725616-A ANTIARTHRITIC AGENTS PFIZER INC. (US) 1988-02-16 — — US disclosed
EP-0208510-A2 1-Substituted oxindole-3-carboxamines as antiinflammatory and analgesic agents PFIZER INC. (US) 1987-01-14 — — EP disclosed
CN-86105309-A Oxindole-3-carbonyl amines the compound that replaces as the 1-of anti-inflammatory and anodyne — 1987-01-14 — — CN disclosed
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