SCHEMBL29808123

SCHEMBL29808123

Cc1cc(CNC(=O)c2ccn(S(=O)(=O)c3ccccc3C)n2)on1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.41
▸ DCTPP1 Q9H773 4/20 0.40
▸ POLB P06746 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ SCD O00767 1/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ GRM5 P41594 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ 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
SCHEMBL22588736 1.00 TDP1 (0.41) TDP1DCTPP1POLBUSP2SCD
SCHEMBL24620566 0.88 TDP1 (0.44) TDP1POLBUSP2RAB9ANPC1
SCHEMBL22588738 0.84 NPC1 (0.41) TDP1POLBUSP2RAB9ANPC1
SCHEMBL29808253 0.83 NPC1 (0.41) TDP1POLBUSP2RAB9ANPC1
SCHEMBL22588752 0.83 NPC1 (0.41) TDP1POLBUSP2RAB9ANPC1
SCHEMBL22588764 0.82 KCNJ1 (0.47) DCTPP1SCDMAPTCYP1A2CYP2D6
SCHEMBL24620637 0.82 THRB (0.45) TDP1POLBUSP2RAB9ANPC1
SCHEMBL29808047 0.82 KCNJ1 (0.47) DCTPP1SCDMAPTCYP1A2CYP2D6
SCHEMBL21875083 0.81 KLKB1 (0.45) POLBUSP2RAB9ANPC1GRM5
SCHEMBL22588494 0.81 DCTPP1 (0.44) DCTPP1SCDGAATP53

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-20220220095-A1 N-((HETEROARYL)METHYL)-1-TOSYL-1H-PYRAZOLE-3-CARBOXAMIDE DERIVATIVES AS Kv3 POTASSIUM CHANNEL ACTIVATORS FOR TREATING NEUROLOGICAL AND PSYCHIATRIC DISORDERS H LUNDBECK AS (DK) 2022-07-14 — — 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-20220220095-A1 N-((HETEROARYL)METHYL)-1-TOSYL-1H-PYRAZOLE-3-CARBOXAMIDE DERIVATIVES AS Kv3 POTASSIUM CHANNEL ACTIVATORS FOR TREATING NEUROLOGICAL AND PSYCHIATRIC DISORDERS KCNA3, KCNK3, KCND3 TDP1 1260/4885DCTPP1 3517/4885POLB 3536/4885

“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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