SCHEMBL5328813

SCHEMBL5328813

COC(=O)CS(=O)(=O)O.[NaH]

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.46
CA12 O43570 6/20 0.43
CA14 Q9ULX7 5/20 0.43
GAA P10253 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MGAM O43451 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
CA9 Q16790 3/20 0.37
CA2 P00918 3/20 0.37
CA7 P43166 2/20 0.37
KMT2A Q03164 2/20 0.34
TET2 Q6N021 1/20 0.34
MEN1 O00255 1/20 0.34
CA1 P00915 1/20 0.34
KDM4E B2RXH2 2/20 0.33
LMNA P02545 2/20 0.33
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33
RECQL P46063 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
SCHEMBL28212451 1.00 TSHR (0.46) TSHRCA12CA14GAAHSD17B10
SCHEMBL1123070 0.97
SCHEMBL29889907 0.95 TSHR (0.46) TSHRCA12CA14GAAHSD17B10
SCHEMBL8375840 0.95 TSHR (0.46) TSHRCA12CA14GAAHSD17B10
SCHEMBL18775983 0.81 TSHR (0.39) TSHRCA12CA14GAAHSD17B10
SCHEMBL10622350 0.78 TSHR (0.52) TSHRCA12CA14GAAHSD17B10
SCHEMBL18935633 0.76
SCHEMBL1968530 0.76
Dimethyl Succinate SCHEMBL27988577 0.76 TSHR (0.72) TSHRCA12CA14GAAHSD17B10
SCHEMBL7009464 0.75 GAA (0.50) CA12GAAHSD17B10MGAMSI

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
WO-2007143672-A1 COMPOSITION COMPRISING JOJOBA CARBOXYLATES IN COMBINATION WITH JOJOBA ALCOHOLS, AND PERSONAL CARE FORMULATIONS COMPRISING SAME DESERT WHALE JOJOBA COMPANY, INC. (US) 2007-12-13 WO disclosed
US-20070286839-A1 COMPOSITION COMPRISING JOJOBA CARBOXYLATES IN COMBINATION WITH JOJOBA ALCOHOL AND COSMETIC FORMULATION COMPRISING SAME ROHDE SORAYA 2007-12-13 US disclosed
US-4283416-A Fungicidal, miticidal and ovicidal alkoxycarbonylalkyl-substituted and carbamylalkyl-substituted N-haloalkylthiosulfonamides CHEVRON RESEARCH COMPANY (US) 1981-08-11 US disclosed
US-4230875-A Fungicidal, miticidal and ovicidal alkoxycarbonylalkyl-substituted and carbamylalkyl-substituted N-haloalkylthiosulfonamides CHEVRON RESEARCH COMPANY (US) 1980-10-28 US disclosed
US-4112237-A Fungicidal, miticidal and ovicidal alkoxycarbonylalkyl-substituted and carbamylalkyl-substituted N-haloalkylthiosulfonamides CHEVRON RESEARCH COMPANY (US) 1978-09-05 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-20070286839-A1 COMPOSITION COMPRISING JOJOBA CARBOXYLATES IN COMBINATION WITH JOJOBA ALCOHOL AND COSMETIC FORMULATION COMPRISING SAME CUTA, TP53RK, POLB TSHR 2299/4885CA12 1935/4885CA14 1906/4885

“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.