SCHEMBL24620569

SCHEMBL24620569

Cc1cnc(CNC(=O)c2ccn(S(=O)(=O)c3ccc(Cl)cc3C)n2)cn1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
WDR5 P61964 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRM4 Q14833 3/20 0.37
DDR1 Q08345 1/20 0.36
GNRHR P30968 1/20 0.36
P2RX3 P56373 2/20 0.36
P2RX2 Q9UBL9 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL29808368 1.00 EPHX2 (0.39) EPHX2NPC1RAB9AWDR5GRIN1
SCHEMBL24620549 0.91 GRM4 (0.44) NPC1RAB9AWDR5GRIN1GRIN2A
SCHEMBL29808543 0.91 GRM4 (0.44) NPC1RAB9AWDR5GRIN1GRIN2A
SCHEMBL24620582 0.90 GRM4 (0.44) EPHX2GRM4P2RX3P2RX2
SCHEMBL22588864 0.89 GRM4 (0.46) EPHX2WDR5GRM4ALDH1A1
SCHEMBL29808192 0.89 GRM4 (0.46) EPHX2WDR5GRM4ALDH1A1
SCHEMBL22600511 0.87 ALDH1A1 (0.47) EPHX2GNRHRALDH1A1
SCHEMBL22588768 0.86 NPC1 (0.43) NPC1RAB9AWDR5GRIN1GRIN2A
SCHEMBL24620575 0.85 ALOX15 (0.42) NPC1RAB9AWDR5GRIN1GRIN2A
SCHEMBL29808214 0.85 ALOX15 (0.42) NPC1RAB9AWDR5GRIN1GRIN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113692405-A Derivatives of N- ((heteroaryl) methyl) -1-tosyl-1H-pyrazole-3-carboxamide as KV3 potassium channel activators for the treatment of neurological or psychiatric disorders H.隆德贝克有限公司 2021-11-23 CN claimed
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
CN-113692405-A Derivatives of N- ((heteroaryl) methyl) -1-tosyl-1H-pyrazole-3-carboxamide as KV3 potassium channel activators for the treatment of neurological or psychiatric disorders H.隆德贝克有限公司 2021-11-23 CN 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 EPHX2 3996/4885NPC1 1024/4885RAB9A 938/4885

“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.