SCHEMBL28415451

SCHEMBL28415451

COc1ccc(S(=O)(=O)Nc2cccnc2-c2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.62
▸ KMT2A Q03164 4/20 0.62
▸ TDP1 Q9NUW8 3/20 0.62
▸ POLB P06746 3/20 0.57
▸ LMNA P02545 2/20 0.57
▸ NFKBIA P25963 1/20 0.57
▸ RELA Q04206 1/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ GLO1 Q04760 1/20 0.57
▸ SLC40A1 Q9NP59 1/20 0.57
▸ MAPT P10636 1/20 0.55
▸ TUBB4A P04350 1/20 0.51
▸ TUBB P07437 1/20 0.51
▸ TUBA3C P0DPH7 1/20 0.51
▸ TUBA1B P68363 1/20 0.51
▸ TUBA4A P68366 1/20 0.51
▸ TUBB4B P68371 1/20 0.51
▸ TUBB3 Q13509 1/20 0.51
▸ TUBB2A Q13885 1/20 0.51
▸ TUBB8 Q3ZCM7 1/20 0.51

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
SCHEMBL28416680 0.91 GLO1 (0.67) MEN1KMT2ATDP1POLBLMNA
SCHEMBL28743185 0.88 MEN1 (0.59) MEN1KMT2ATDP1POLBLMNA
SCHEMBL28418719 0.86 CKS1B (0.65) MEN1KMT2ATDP1POLBLMNA
SCHEMBL28410436 0.85 GLO1 (0.60) MEN1KMT2ATDP1POLBLMNA
SCHEMBL28410557 0.85 TUBB4A (0.69) MEN1KMT2ATDP1POLBLMNA
SCHEMBL28422416 0.82 MEN1 (0.63) MEN1KMT2ATDP1POLBLMNA
SCHEMBL28410068 0.82 STAT3 (0.69) MEN1KMT2ATDP1POLBLMNA
SCHEMBL28410070 0.82 KMT2A (0.57) MEN1KMT2ATDP1POLBLMNA
SCHEMBL28418080 0.81 GLO1 (0.58) MEN1KMT2ATDP1POLBLMNA
SCHEMBL28412972 0.81 GLO1 (0.63) MEN1KMT2ATDP1POLBLMNA

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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