SCHEMBL21875178

SCHEMBL21875178

O=C(NCc1cnccn1)c1ccn(S(=O)(=O)c2ccc(F)cc2)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 1/20 0.47
▸ NAMPT P43490 7/20 0.47
▸ CYP2C9 P11712 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ KLKB1 P03952 4/20 0.42
▸ HPGDS O60760 1/20 0.41
▸ CA2 P00918 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PIK3CA P42336 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL21875134 0.89 ALDH1A1 (0.52) GRM4NAMPTCYP2C9KLKB1HPGDS
SCHEMBL21875060 0.89 GRM4 (0.47) GRM4NAMPTCYP2C9KLKB1HPGDS
SCHEMBL21875107 0.87 KLKB1 (0.58) NAMPTCYP2C9KDM4EKLKB1HPGDS
SCHEMBL21875093 0.84 NAMPT (0.46) GRM4NAMPTKLKB1ALDH1A1
SCHEMBL21875118 0.83 MEN1 (0.47) NAMPTCYP2C9KLKB1HPGDSCA2
SCHEMBL21875089 0.80 NAMPT (0.47) GRM4NAMPTKLKB1
SCHEMBL21875139 0.80 NAMPT (0.48) GRM4NAMPTKLKB1HPGDSPIK3CA
SCHEMBL21875088 0.79 KLKB1 (0.47) GRM4NAMPTCYP2C9KLKB1ALDH1A1
SCHEMBL21875158 0.78 SMN1; SMN2 (0.47) GRM4NAMPTCYP2C9KLKB1L3MBTL1
SCHEMBL21875171 0.75 KLKB1 (0.49) GRM4NAMPTKLKB1CA2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113056461-A Arylsulfonyl pyrrole carboxamide derivatives as Kv3 potassium channel activators H.隆德贝克有限公司 2021-06-29 — — CN claimed
US-20200131156-A1 ARYLSULFONYLPYROLECARBOXAMIDE DERIVATIVES AS Kv3 POTASSIUM CHANNEL ACTIVATORS H. LUNDBECK A/S (DK) 2020-04-30 — — US claimed
CN-113056461-A Arylsulfonyl pyrrole carboxamide derivatives as Kv3 potassium channel activators H.隆德贝克有限公司 2021-06-29 — — CN disclosed
US-20200131156-A1 ARYLSULFONYLPYROLECARBOXAMIDE DERIVATIVES AS Kv3 POTASSIUM CHANNEL ACTIVATORS H. LUNDBECK A/S (DK) 2020-04-30 — — US disclosed
US-20200131156-A1 ARYLSULFONYLPYROLECARBOXAMIDE DERIVATIVES AS Kv3 POTASSIUM CHANNEL ACTIVATORS H. LUNDBECK A/S (DK) 2020-04-30 — — 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-20200131156-A1 ARYLSULFONYLPYROLECARBOXAMIDE DERIVATIVES AS Kv3 POTASSIUM CHANNEL ACTIVATORS KCNA3, KCNN3, KCNK3 GRM4 1103/4885NAMPT 3382/4885CYP2C9 3279/4885

“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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