SCHEMBL24215474

SCHEMBL24215474

O=C(O)c1cccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.70
▸ KMT2A Q03164 4/20 0.70
▸ SLC25A1 P53007 2/20 0.63
▸ POLB P06746 2/20 0.61
▸ CASP3 P42574 1/20 0.60
▸ SENP8 Q96LD8 1/20 0.60
▸ SENP7 Q9BQF6 1/20 0.60
▸ SENP6 Q9GZR1 1/20 0.60
▸ WDR5 P61964 2/20 0.59
▸ PFKFB3 Q16875 1/20 0.57
▸ MAPT P10636 2/20 0.57
▸ PLG P00747 1/20 0.55
▸ PLAU P00749 1/20 0.55
▸ DNMT1 P26358 1/20 0.54
▸ DNMT3A Q9Y6K1 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ VCAM1 P19320 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL30515749 1.00 MEN1 (0.70) MEN1KMT2ASLC25A1POLBCASP3
SCHEMBL7371667 0.92 KMT2A (0.62) MEN1KMT2ASLC25A1POLBCASP3
SCHEMBL6205157 0.86 KMT2A (0.53) MEN1KMT2ASLC25A1POLBCASP3
SCHEMBL6204952 0.86 KMT2A (0.53) MEN1KMT2ASLC25A1POLBCASP3
SCHEMBL6205161 0.86 KMT2A (0.53) MEN1KMT2ASLC25A1POLBCASP3
SCHEMBL3619380 0.85 SLC25A1 (0.67) MEN1KMT2ASLC25A1MAPTDNMT1
SCHEMBL3615295 0.84 VCAM1 (0.59) MEN1KMT2ASLC25A1MAPTDNMT1
SCHEMBL5059972 0.83 KMT2A (0.57) MEN1KMT2ASLC25A1POLBWDR5
SCHEMBL8366106 0.81 CASP3 (0.81) MEN1KMT2ASLC25A1POLBCASP3
SCHEMBL11752812 0.81 VCAM1 (0.60) MEN1KMT2ASLC25A1MAPTDNMT1

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
WO-2022013295-A1 THE ROLE OF PMCIC IN THE TUMOR MICROENVIRONMENT UNIVERSITÄTSKLINIKUM REGENSBURG (DE) 2022-01-20 — — WO disclosed
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