SCHEMBL3183312

SCHEMBL3183312

CC(C)C(=O)Sc1ccccc1C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.65
▸ CA1 P00915 2/20 0.65
▸ CA2 P00918 2/20 0.65
▸ CA4 P22748 2/20 0.65
▸ CA7 P43166 2/20 0.65
▸ CA9 Q16790 2/20 0.65
▸ POLB P06746 3/20 0.57
▸ MDM4 O15151 2/20 0.54
▸ TP53 P04637 2/20 0.54
▸ MDM2 Q00987 2/20 0.54
▸ CYP1A2 P05177 1/20 0.49
▸ ALDH1A1 P00352 6/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ RAB9A P51151 2/20 0.45
▸ MAPT P10636 2/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ HSP90AA1 P07900 1/20 0.43
▸ KDM4E B2RXH2 3/20 0.42
▸ HMGB1 P09429 1/20 0.41

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
SCHEMBL3682300 0.79 CA12 (1.00) CA12CA1CA2CA4CA7
SCHEMBL18113237 0.77 TSHR (0.59) MDM4TP53MDM2CYP1A2ALDH1A1
SCHEMBL3309695 0.77 POLB (0.62) CA12CA1CA2CA4CA7
SCHEMBL1868785 0.74 POLB (0.58) CA12CA1CA2CA4CA7
SCHEMBL18113281 0.74 CA12 (0.65) CA12CA1CA2CA4CA7
SCHEMBL10397164 0.74 CA12 (0.65) CA12CA1CA2CA4CA7
SCHEMBL18113230 0.74 CA12 (0.65) CA12CA1CA2CA4CA7
SCHEMBL10745516 0.74 POLB (0.63) CA12CA1CA2CA4CA7
SCHEMBL3389925 0.74 POLB (0.58) CA12CA1CA2CA4CA7
SCHEMBL19334227 0.74 POLB (0.68) CA12CA1CA2CA4CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7659267-B2 1,3-Benzothiazinone derivatives, process for producing the same use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-02-09 — — US disclosed
US-20060052371-A1 1,3-Benzothiazinone derivatives, process for producing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-03-09 — — US disclosed
EP-1568697-A1 1,3-BENZOTHIAZINONE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2005-08-31 — — EP 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-20060052371-A1 1,3-Benzothiazinone derivatives, process for producing the same and use thereof MIF, FOXM1, HMGB3 CA12 4312/4885CA1 3436/4885CA2 2976/4885

“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.

Send feedback