SCHEMBL6235555

SCHEMBL6235555

O=C1NC(=O)C2(CCCC2SCc2ccccc2)N1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 2/20 0.43
DDB1 Q16531 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
GAA P10253 2/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
CYP19A1 P11511 1/20 0.34
CACNA1F O60840 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
HTR2A P28223 1/20 0.33
HRH1 P35367 1/20 0.33
SCN1A P35498 1/20 0.33
SCN4A P35499 1/20 0.33
BLM P54132 1/20 0.33
PMP22 Q01453 1/20 0.33

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
SCHEMBL940436 0.96 GAA (0.44) CRBNDDB1TDP1GAAHPGD
Benzenemethanethiol SCHEMBL6807689 0.91 GAA (0.40) CRBNDDB1TDP1GAAHPGD
SCHEMBL6239837 0.78 CRBN (0.39) CRBNDDB1GAAHPGDALDH1A1
SCHEMBL15229601 0.74 TDP1 (0.42) TDP1GAAHPGDMAPK1ALDH1A1
SCHEMBL12880750 0.72 TDP1 (0.44) TDP1GAAHPGDMAPK1ALDH1A1
SCHEMBL12880751 0.72 TDP1 (0.44) TDP1GAAHPGDMAPK1ALDH1A1
SCHEMBL6233315 0.69 CRBN (0.43) CRBNDDB1TDP1GAAHPGD
SCHEMBL11276596 0.69 DDB1 (0.40) CRBNDDB1HPGDSMN1; SMN2
SCHEMBL13053343 0.68 ALDH1A1 (0.43) CRBNDDB1TDP1GAAHPGD
SCHEMBL13053338 0.68 ALDH1A1 (0.43) CRBNDDB1TDP1GAAHPGD

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
US-20050256176-A1 Sulphonamide derivatives and their use as tace inhibitors ASTAZENECA AB (SE) 2005-11-17 US disclosed
EP-1539740-A1 SULPHONAMIDE DERIVATIVES AND THEIR USE AS TACE INHIBITORS AstraZeneca AB (SE) 2005-06-15 EP disclosed
WO-2004024715-A1 SULPHONAMIDE DERIVATIVES AND THEIR USE AS TACE INHIBITORS ASTRAZENECA AB (SE) 2004-03-25 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-20050256176-A1 Sulphonamide derivatives and their use as tace inhibitors ADAM10, ADAM17, TNF CRBN 3305/4885DDB1 771/4885TDP1 1511/4885

“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.