SCHEMBL25848715

SCHEMBL25848715

Cc1ccc(S(=O)(=O)NCCNC(=O)OC(C)(C)C)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.54
TSHR P16473 1/20 0.54
USP2 O75604 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CA12 O43570 3/20 0.51
CA1 P00915 3/20 0.51
CA2 P00918 3/20 0.51
CA9 Q16790 3/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPT P10636 1/20 0.50
PSMB8 P28062 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HPGD P15428 2/20 0.49
LMNA P02545 1/20 0.49
HTT P42858 1/20 0.49

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
SCHEMBL5094941 0.91 ALDH1A1 (0.60) ALDH1A1TSHRCA12CA1CA2
SCHEMBL5308838 0.88 CA1 (0.50) ALDH1A1CA12CA1CA2CA9
SCHEMBL29695330 0.88 CA1 (0.50) ALDH1A1USP2CA12CA1CA2
SCHEMBL26633424 0.88 CA1 (0.54) CA12CA1CA2CA9
SCHEMBL14831226 0.87 USP2 (0.56) ALDH1A1TSHRUSP2CA12CA1
SCHEMBL29695282 0.86 ALDH1A1 (0.58) ALDH1A1USP2CA12CA1CA2
SCHEMBL23693422 0.85 RAB9A (0.48) ALDH1A1TSHRCA12CA1CA2
SCHEMBL27202571 0.85 MMP2 (0.53) ALDH1A1TSHRUSP2CA12CA1
SCHEMBL31227455 0.85 CA1 (0.48) ALDH1A1TSHRUSP2L3MBTL1CA12
SCHEMBL29695141 0.84 CA2 (0.53) ALDH1A1TSHRL3MBTL1CA12CA1

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-20240130367-A1 PLANT GROWTH PROMOTERS UNIVERSITY OF DURHAM (GB) 2024-04-25 US disclosed
EP-4266883-A1 PLANT GROWTH PROMOTERS University of Durham (GB) 2023-11-01 EP disclosed
CN-116916750-A plant growth promoter 杜伦大学 2023-10-20 CN disclosed
EP-3793990-B1 ANTIBACTERIAL COMPOUNDS INFEX THERAPEUTICS LTD (GB) 2023-07-19 EP disclosed
WO-2022136838-A1 PLANT GROWTH PROMOTERS UNIVERSITY OF DURHAM (GB) 2022-06-30 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-20240130367-A1 PLANT GROWTH PROMOTERS MYCBP, GLB1, GUSB ALDH1A1 770/4885TSHR 2377/4885USP2 520/4885

“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.