SCHEMBL24334941

SCHEMBL24334941

CS(=O)(=O)c1ccc(-c2cc(F)nc(NCc3cccs3)n2)cc1

nearest known ligand 0.75

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 16/20 0.75
▸ KDM4E B2RXH2 4/20 0.61
▸ LMNA P02545 4/20 0.61
▸ ALDH1A1 P00352 3/20 0.61
▸ MAPT P10636 3/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.61
▸ L3MBTL1 Q9Y468 3/20 0.61
▸ HPGD P15428 2/20 0.55
▸ ATM Q13315 1/20 0.55
▸ TLR8 Q9NR97 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ PTGS1 P23219 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
SCHEMBL22828106 0.87 PTGS2 (0.75) PTGS2KDM4ELMNAALDH1A1MAPT
SCHEMBL24335191 0.82 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL24334901 0.82 PTGS2 (0.68) PTGS2KDM4ELMNAALDH1A1MAPT
SCHEMBL23110876 0.82 PTGS2 (0.68) PTGS2
SCHEMBL22828104 0.81 PTGS2 (0.75) PTGS2LMNAMAPTSMN1; SMN2L3MBTL1
SCHEMBL24334957 0.81 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL22827966 0.81 PTGS2 (0.79) PTGS2
SCHEMBL23110886 0.77 PTGS2 (0.61) PTGS2KDM4ELMNAALDH1A1MAPT
SCHEMBL23110602 0.76 PTGS2 (0.63) PTGS2
SCHEMBL24334889 0.76 PTGS2 (0.52) PTGS2PTGS1

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-20220106275-A1 RADIOLABELED COMPOUNDS AND USES THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2022-04-07 — — 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-20220106275-A1 RADIOLABELED COMPOUNDS AND USES THEREOF PAICS, TMEM14C, SLCO1B1 PTGS2 4365/4885KDM4E 4129/4885LMNA 2728/4885

“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.

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