SCHEMBL1177404

SCHEMBL1177404

O=S(=O)(O)c1ccc2ccccc2c1.[Ag]

nearest known ligand 0.62

Known targets — ChEMBL curated mechanism

OPRM1

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SNCA P37840 2/20 0.62
LMNA P02545 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.55
F2 P00734 2/20 0.55
PRSS1 P07477 2/20 0.55
PRSS2 P07478 2/20 0.55
PRSS3 P35030 2/20 0.55
MCOLN3 Q8TDD5 2/20 0.53
TSHR P16473 2/20 0.53
ALDH1A1 P00352 2/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
CASP6 P55212 1/20 0.52
HSD17B10 Q99714 1/20 0.52
PKM P14618 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
HTT P42858 1/20 0.47

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
SCHEMBL28275730 0.98 SNCA (0.65) SNCALMNAL3MBTL1F2PRSS1
SCHEMBL304050 0.98 SNCA (0.65) SNCALMNAL3MBTL1F2PRSS1
Naphthalene SCHEMBL28216326 0.98 SNCA (0.65) SNCALMNAL3MBTL1F2PRSS1
SCHEMBL29357423 0.98 SNCA (0.65) SNCALMNAL3MBTL1F2PRSS1
SCHEMBL1556 0.98 SNCA (0.65) SNCALMNAL3MBTL1F2PRSS1
SCHEMBL29857297 0.98 SNCA (0.65) SNCALMNAL3MBTL1F2PRSS1
SCHEMBL1589609 0.96 SNCA (0.62) SNCALMNAL3MBTL1F2PRSS1
Sulfuric Acid SCHEMBL7067030 0.96 SNCA (0.62) SNCALMNAL3MBTL1F2PRSS1
SCHEMBL1588808 0.96 SNCA (0.62) SNCALMNAL3MBTL1F2PRSS1
Hydrochloric Acid SCHEMBL3441755 0.96 SNCA (0.62) SNCALMNAL3MBTL1F2PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8692014-B2 Acid addition salts of 5-aminolevulinic acid or its derivatives PHOTOCURE ASA (NO) 2014-04-08 US disclosed
US-20110125012-A1 ACID ADDITION SALTS OF 5-AMINOLEVULINIC ACID OR ITS DERIVATIVES BRAENDEN JON ERIK 2011-05-26 US disclosed
EP-2308830-A1 Acid addition salts of 5-aminolevulinic acid or its derivatives Photocure ASA (NO) 2011-04-13 EP disclosed
US-7888526-B2 Nonhygroscopic photosensitizing agents; sulphonate, hydrobromide, sulfate, nitrate and/or phosphate derivatives; diagnosing skin disorders PHOTOCURE ASA (NO) 2011-02-15 US disclosed
US-20080064752-A1 Acid Addition Salts Of-5-Aminolevulinic Acid Or Its Derivatives PHOTOCURE ASA (NO) 2008-03-13 US disclosed
EP-1727786-A1 ACID ADDITION SALTS OF 5-AMINOLEVULINIC ACID OR ITS DERIVATIVES Photocure ASA (NO) 2006-12-06 EP disclosed
WO-2005092838-A1 ACID ADDITION SALTS OF 5-AMINOLEVULINIC ACID OR ITS DERIVATIVES PHOTOCURE ASA (NO) 2005-10-06 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-20080064752-A1 Acid Addition Salts Of-5-Aminolevulinic Acid Or Its Derivatives ALAD, AASDHPPT, ABAT SNCA 1492/4885LMNA 3222/4885L3MBTL1 2982/4885

“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.