SCHEMBL29082591

SCHEMBL29082591

COc1nc(NS(=O)(=O)c2c[nH]c3cc(Cl)ccc23)nc(OC)c1[O]

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 1/20 0.43
▸ CCR4 P51679 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ SGK1 O00141 3/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ IDO1 P14902 1/20 0.37
▸ GPR84 Q9NQS5 1/20 0.37
▸ SLC6A4 P31645 1/20 0.36
▸ TP53 P04637 2/20 0.36
▸ CPT1A P50416 1/20 0.36
▸ HTR6 P50406 1/20 0.36

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
SCHEMBL26980229 0.92 SMN1; SMN2 (0.45) NR4A2CCR4SMN1; SMN2HIF1ASGK1
SCHEMBL30559619 0.91 NR4A2 (0.43) NR4A2CCR4SMN1; SMN2HIF1ASGK1
SCHEMBL26980760 0.91 NR4A2 (0.43) NR4A2CCR4SMN1; SMN2HIF1ASGK1
SCHEMBL26980246 0.90 CCR4 (0.43) NR4A2CCR4SMN1; SMN2HIF1ASGK1
SCHEMBL29903833 0.90 CCR4 (0.43) NR4A2CCR4SMN1; SMN2HIF1ASGK1
SCHEMBL26980288 0.89 NR4A2 (0.41) NR4A2CCR4SMN1; SMN2HIF1ASGK1
SCHEMBL29903583 0.89 NR4A2 (0.41) NR4A2CCR4SMN1; SMN2HIF1ASGK1
SCHEMBL30559627 0.88 NR4A2 (0.40) NR4A2CCR4SMN1; SMN2HIF1ASGK1
SCHEMBL26980285 0.88 NR4A2 (0.40) NR4A2CCR4SMN1; SMN2HIF1ASGK1
SCHEMBL26980766 0.88 NR4A2 (0.40) NR4A2CCR4SMN1; SMN2HIF1ASGK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116829550-A Pyrimidine-2-ylsulfonamide derivatives 豪夫迈·罗氏有限公司 2023-09-29 — — CN disclosed
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