SCHEMBL6345843

SCHEMBL6345843

O=[N+]([O-])C1CCCCC1(O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.38
SLC6A2 P23975 3/20 0.37
SLC6A4 P31645 3/20 0.37
SLC6A3 Q01959 3/20 0.37
CNR2 P34972 2/20 0.34
CNR1 P21554 1/20 0.34
POLB P06746 1/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KMT2A Q03164 1/20 0.34
FASN P49327 1/20 0.34

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
SCHEMBL6354142 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL6354144 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL6357512 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL6357511 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL6354146 0.75 SLC6A2 (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL5718315 0.71 SLC6A2 (0.44) SLC6A2SLC6A4SLC6A3MEN1KMT2A
Hydrochloric Acid SCHEMBL5701109 0.70 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3MEN1ALDH1A1
SCHEMBL6345766 0.70 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3
SCHEMBL6345769 0.70 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3
SCHEMBL6345770 0.70 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6900353-B2 Cyclopentyl sulfonamide derivatives ELI LILLY AND COMPANY (US) 2005-05-31 US disclosed
US-20040067984-A1 Cyclopentyl sulfonamide derivatives CANTRELL BUDDY EUGENE (US) 2004-04-08 US disclosed
EP-1334087-A1 CYCLOALKYLFLUOROSULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2003-08-13 EP disclosed
WO-2002032858-A1 CYCLOALKYLFLUOROSULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 2002-04-25 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-20040067984-A1 Cyclopentyl sulfonamide derivatives GRIN2A, GRIN1, GRIK5 PGR 2809/4885SLC6A2 136/4885SLC6A4 74/4885

“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.