SCHEMBL28418717

SCHEMBL28418717

COc1ccc(S(=O)(=O)Nc2cccnc2-c2ccc(C#N)c(F)c2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 4/20 0.72
▸ TUBB4A P04350 2/20 0.72
▸ TUBB P07437 2/20 0.72
▸ TUBA3C P0DPH7 2/20 0.72
▸ TUBA1B P68363 2/20 0.72
▸ TUBA4A P68366 2/20 0.72
▸ TUBB4B P68371 2/20 0.72
▸ TUBB3 Q13509 2/20 0.72
▸ TUBB2A Q13885 2/20 0.72
▸ TUBB8 Q3ZCM7 2/20 0.72
▸ TUBA3E Q6PEY2 2/20 0.72
▸ TUBA1A Q71U36 2/20 0.72
▸ TUBA1C Q9BQE3 2/20 0.72
▸ TUBB6 Q9BUF5 2/20 0.72
▸ TUBB2B Q9BVA1 2/20 0.72
▸ TUBB1 Q9H4B7 2/20 0.72
▸ GLO1 Q04760 1/20 0.51
▸ SLC40A1 Q9NP59 1/20 0.51
▸ KIT P10721 2/20 0.50
▸ SLC22A12 Q96S37 5/20 0.49

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
SCHEMBL28412987 0.89 TUBB4A (0.56) STAT3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28418715 0.89 TUBB4A (0.56) STAT3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28410206 0.89 TUBB4A (0.56) STAT3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28415837 0.88 TUBB4A (0.54) STAT3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28414561 0.88 TUBB4A (0.56) STAT3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28412981 0.87 TUBB4A (0.53) STAT3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28410119 0.85 SLC40A1 (0.52) STAT3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL30818284 0.84 STAT3 (1.00) STAT3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28410068 0.83 STAT3 (0.69) STAT3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28416680 0.83 GLO1 (0.67) STAT3TUBB4ATUBBTUBA3CTUBA1B

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-111320575-B Pyridine-2-aryl-3-sulfonamide compound and synthesis method and application thereof 浙江大学 2022-04-05 — — CN disclosed
CN-111320575-A Pyridine-2-aryl-3-sulfonamide compound and synthesis method and application thereof 浙江大学 2020-06-23 — — CN disclosed
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