SCHEMBL25010093

SCHEMBL25010093

CCCS(=O)(=O)c1oc(-c2ccc(F)cc2)nc1S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.73

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 12/20 0.73
MAPT P10636 11/20 0.73
SMN1; SMN2 Q16637 6/20 0.72
VDR P11473 2/20 0.64
POLB P06746 1/20 0.60
THRB P10828 1/20 0.59
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
RXFP1 Q9HBX9 1/20 0.49
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL25010118 0.94 TP53 (0.79) TP53MAPTSMN1; SMN2VDRPOLB
SCHEMBL25010473 0.94 TP53 (0.63) TP53MAPTSMN1; SMN2VDRPOLB
SCHEMBL25011030 0.94 TP53 (0.82) TP53MAPTSMN1; SMN2VDRPOLB
SCHEMBL25011049 0.89 TP53 (0.85) TP53MAPTSMN1; SMN2VDRPOLB
SCHEMBL25009593 0.89 TP53 (0.87) TP53MAPTSMN1; SMN2VDRPOLB
SCHEMBL25009659 0.89 TP53 (0.63) TP53MAPTSMN1; SMN2VDRTHRB
SCHEMBL25010462 0.88 TP53 (0.69) TP53MAPTSMN1; SMN2VDRPOLB
SCHEMBL25009182 0.87 TP53 (0.91) TP53MAPTSMN1; SMN2VDRPOLB
SCHEMBL23416180 0.87 VDR (0.57) TP53MAPTSMN1; SMN2VDRPOLB
SCHEMBL25010122 0.86 TP53 (0.85) TP53MAPTSMN1; SMN2VDRPOLB

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 TP53 376/4885MAPT 2111/4885SMN1; SMN2 2605/4885

“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.