SCHEMBL4867540

SCHEMBL4867540

C=Cc1ccccc1[S+]([O-])C(C)C

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL4869984 0.81 LMNA (0.44) ALDH1A1
SCHEMBL5793825 0.78 ALDH1A1 (0.41) ALDH1A1
SCHEMBL19225697 0.74 ALDH1A1 (0.41) ALDH1A1
SCHEMBL20585106 0.72 ALDH1A1 (0.40) ALDH1A1
SCHEMBL17529259 0.71 ACHE (0.39) ALDH1A1
SCHEMBL16309640 0.71 ALDH1A1 (0.40) ALDH1A1
SCHEMBL22368948 0.69 ALDH1A1 (0.34) ALDH1A1
SCHEMBL21637950 0.67 MAPT (0.38) ALDH1A1
Ethane SCHEMBL29266735 0.66 ALDH1A1 (0.57) ALDH1A1
SCHEMBL2064114 0.65 ALDH1A1 (0.41) ALDH1A1

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
US-8183382-B2 ruthenium transition metal complexes used as cyclization catalyst EVONIK DEGUSSA GMBH (DE) 2012-05-22 US disclosed
US-8183382-B2 ruthenium transition metal complexes used as cyclization catalyst EVONIK DEGUSSA GMBH (DE) 2012-05-22 US disclosed
EP-1990348-A2 Metathesis catalysts containing sulphur Evonik Degussa GmbH (DE) 2008-11-12 EP disclosed
US-20080275247-A1 SULPHUR-CONTAINING METATHESIS CATALYSTS EVONIK DEGUSSA GMBH (DE) 2008-11-06 US disclosed
US-20080275247-A1 SULPHUR-CONTAINING METATHESIS CATALYSTS EVONIK DEGUSSA GMBH (DE) 2008-11-06 US 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-20080275247-A1 SULPHUR-CONTAINING METATHESIS CATALYSTS TST, MPST, CBS ALDH1A1 293/4885

“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.