SCHEMBL30049800

SCHEMBL30049800

N#Cc1cc(CN2CCC3(CCCN(S(=O)(=O)c4ccc(N5CCOC5=O)nc4)C3)CC2)ccc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 8/20 0.43
▸ CYP2D6 P10635 7/20 0.43
▸ USP2 O75604 5/20 0.43
▸ CYP1A2 P05177 3/20 0.43
▸ ALDH1A1 P00352 5/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ LMNA P02545 2/20 0.39
▸ TSHR P16473 7/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ HCRTR1 O43613 1/20 0.38
▸ HCRTR2 O43614 1/20 0.38
▸ KCNJ1 P48048 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ SCN9A Q15858 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ DPP4 P27487 1/20 0.35

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
SCHEMBL27162660 1.00 CYP3A4 (0.43) CYP3A4CYP2D6USP2CYP1A2ALDH1A1
SCHEMBL27162506 0.96 ALDH1A1 (0.41) CYP3A4CYP2D6USP2CYP1A2ALDH1A1
SCHEMBL30049837 0.96 ALDH1A1 (0.41) CYP3A4CYP2D6USP2CYP1A2ALDH1A1
SCHEMBL27162540 0.93 CYP3A4 (0.47) CYP3A4CYP2D6USP2CYP1A2ALDH1A1
SCHEMBL30049716 0.93 CYP3A4 (0.47) CYP3A4CYP2D6USP2CYP1A2ALDH1A1
SCHEMBL30051119 0.92 ALDH1A1 (0.43) CYP3A4CYP2D6USP2ALDH1A1SMN1; SMN2
SCHEMBL27162256 0.92 ALDH1A1 (0.43) CYP3A4CYP2D6USP2ALDH1A1SMN1; SMN2
SCHEMBL30049557 0.90 ALDH1A1 (0.41) CYP3A4CYP2D6USP2CYP1A2ALDH1A1
SCHEMBL27162302 0.90 ALDH1A1 (0.41) CYP3A4CYP2D6USP2CYP1A2ALDH1A1
SCHEMBL30050906 0.87 CYP3A4 (0.47) CYP3A4CYP2D6USP2CYP1A2ALDH1A1

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
EP-4330248-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SIGMA LIGANDS Acondicionamiento Tarrasense (ES) 2024-03-06 — — EP claimed
WO-2022229405-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SIGMA LIGANDS ACONDICIONAMIENTO TARRASENSE (ES) 2022-11-03 — — WO claimed
US-20240254115-A1 New Pyridine-Sulfonamide Derivatives as Sigma Ligands ACONDICIONAMIENTO TARRASENSE (ES) 2024-08-01 — — US disclosed
EP-4330248-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SIGMA LIGANDS Acondicionamiento Tarrasense (ES) 2024-03-06 — — EP disclosed
WO-2022229405-A1 PYRIDINE-SULFONAMIDE DERIVATIVES AS SIGMA LIGANDS ACONDICIONAMIENTO TARRASENSE (ES) 2022-11-03 — — WO 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-20240254115-A1 New Pyridine-Sulfonamide Derivatives as Sigma Ligands SIGMAR1, TMEM97, OPRD1 CYP3A4 497/4885CYP2D6 514/4885USP2 2065/4885

“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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