SCHEMBL5326524

SCHEMBL5326524

O=C(c1ccc(-c2ccc(=O)[nH]n2)cc1)N1CCN(S(=O)(=O)c2ccc3cc[nH]c3c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
ALDH1A1 P00352 2/20 0.54
NUDT15 Q9NV35 1/20 0.51
MAPT P10636 3/20 0.51
GHSR Q92847 2/20 0.49
ATM Q13315 1/20 0.47
F10 P00742 4/20 0.47
THRB P10828 1/20 0.46
LMNA P02545 3/20 0.46
MEN1 O00255 1/20 0.44
USP2 O75604 1/20 0.44
GAA P10253 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL5322343 0.88 ALDH1A1 (0.53) L3MBTL1ALDH1A1MAPTATMF10
SCHEMBL6152346 0.85 ALDH1A1 (0.59) L3MBTL1ALDH1A1MAPTATMF10
SCHEMBL6152664 0.85 F10 (0.65) L3MBTL1ALDH1A1MAPTATMF10
SCHEMBL5323222 0.85 L3MBTL1 (0.47) L3MBTL1ALDH1A1MAPTATMF10
SCHEMBL5327115 0.84 GHSR (0.50) L3MBTL1NUDT15MAPTGHSRATM
SCHEMBL5324846 0.84 HRH3 (0.54) L3MBTL1NUDT15MAPTGHSRATM
SCHEMBL5327745 0.84 MAPT (0.52) L3MBTL1ALDH1A1MAPTF10THRB
SCHEMBL5326485 0.84 ALDH1A1 (0.48) L3MBTL1ALDH1A1MAPTATMF10
SCHEMBL5324555 0.82 ATM (0.63) L3MBTL1NUDT15GHSRATMF10
SCHEMBL14095701 0.78 F10 (0.50) L3MBTL1ALDH1A1MAPTATMF10

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
WO-2007019397-A2 6-MEMBERED ARYL AND HETEROARYL DERIVATIVES FOR THE TREATMENT OF HEPATITIS C VIRUS GENELABS TECHNOLOGIES, INC. (US) 2007-02-15 WO disclosed
US-20070032488-A1 6-Membered aryl and heteroaryl derivatives for treating viruses GENELABS TECHNOLOGIES, INC. 2007-02-08 US disclosed
WO-2007008145-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS INHIBITORS OF FACTOR XA ASTRAZENECA AB (SE) 2007-01-18 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-20070032488-A1 6-Membered aryl and heteroaryl derivatives for treating viruses HAVCR2, MAVS, EIF2AK2 L3MBTL1 885/4885ALDH1A1 1740/4885NUDT15 759/4885

“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.