SCHEMBL25009043

SCHEMBL25009043

CS(=O)(=O)c1[nH]nc(N)c1S(=O)(=O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 4/20 0.41
AKR1B1 P15121 1/20 0.41
MAPT P10636 3/20 0.40
HTR6 P50406 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 3/20 0.39
MEN1 O00255 2/20 0.39
AKT2 P31751 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA13 Q8N1Q1 1/20 0.39
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.37
DRD2 P14416 1/20 0.37
HTR2C P28335 1/20 0.37
HTR7 P34969 1/20 0.37
HTR2B P41595 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL23415979 0.75 MAPT (0.38) FFAR2AKR1B1MAPTHTR6KMT2A
SCHEMBL7140108 0.68 MEN1 (0.48) FFAR2AKR1B1HTR6KMT2AMEN1
SCHEMBL7139924 0.68 MEN1 (0.74) FFAR2MAPTHTR6KMT2AMEN1
SCHEMBL589733 0.66 JAK2 (0.55) HTR6KDM4E
SCHEMBL28373206 0.65 MEN1 (0.43) FFAR2AKR1B1MAPTHTR6KMT2A
(Phenylsulfonyl)Benzene SCHEMBL10870153 0.64 HTR6 (0.82) MAPTHTR6ALDH1A1CA12CA1
(Phenylsulfonyl)Benzene SCHEMBL11592325 0.64 HTR6 (0.82) MAPTHTR6ALDH1A1CA12CA1
SCHEMBL27470230 0.64 HTR6 (0.63) FFAR2MAPTHTR6KMT2AALDH1A1
SCHEMBL7144417 0.64 HTR6 (0.52) AKR1B1HTR6KMT2AALDH1A1KDM4E
SCHEMBL13184162 0.64 AKR1B1 (0.57) AKR1B1MAPTHTR6KMT2AALDH1A1

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
US-20230041576-A1 METHODS AND MATERIALS FOR INHIBITING NF-kB ACTIVITY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2023-02-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230041576-A1 METHODS AND MATERIALS FOR INHIBITING NF-kB ACTIVITY NFKBIA, IKBKB, NFKB2 FFAR2 4769/4885AKR1B1 3822/4885MAPT 2111/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.