SCHEMBL3480489

SCHEMBL3480489

O=P(O)(O)CNS(=O)(=O)c1ccc(-c2ccc(O)c(O)c2)s1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SNCA P37840 6/20 0.47
MAPT P10636 2/20 0.43
HSD17B1 P14061 3/20 0.40
HSD17B2 P37059 3/20 0.40
PKLR P30613 1/20 0.36
BCL2 P10415 3/20 0.35
BCL2L1 Q07817 3/20 0.35
MCL1 Q07820 3/20 0.35
P2RY14 Q15391 4/20 0.34
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
POLB P06746 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
SCHEMBL3480501 0.81 MAPT (0.48) MAPT
SCHEMBL3920516 0.79 CNR2 (0.36) BCL2BCL2L1MCL1P2RY14
SCHEMBL3480342 0.79 SNCA (0.46) SNCAMAPTHSD17B1HSD17B2PKLR
SCHEMBL3480451 0.78 ATIC (0.46) P2RY14POLB
SCHEMBL3480263 0.77 MAPT (0.34) MAPTP2RY14
SCHEMBL16667405 0.76 P2RY14 (0.38) MAPTP2RY14
SCHEMBL3480445 0.76 SERPINE1 (0.38)
SCHEMBL3480434 0.75 MMP13 (0.45) POLB
SCHEMBL3480234 0.74 SNCA (0.63) SNCAMAPTHSD17B1HSD17B2ESR1
SCHEMBL4427998 0.72 SMN1; SMN2 (0.55) MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100317625-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE 92229129 QUEBEC INC. (CA) 2010-12-16 US claimed
EP-2024376-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE Merck & Co., Inc. (US) 2009-02-18 EP claimed
WO-2007139729-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE MERCK & CO., INC. (US) 2007-12-06 WO claimed
US-20100317625-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE 92229129 QUEBEC INC. (CA) 2010-12-16 US disclosed
EP-2024376-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE Merck & Co., Inc. (US) 2009-02-18 EP disclosed
WO-2007139729-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE MERCK & CO., INC. (US) 2007-12-06 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-20100317625-A1 NOVEL SULFONAMIDOMETHYLPHOSPHONATE INHIBITORS OF BETA-LACTAMASE MGAM, BPGM, PPME1 SNCA 2555/4885MAPT 4576/4885HSD17B1 2429/4885

“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.