SCHEMBL6937173

SCHEMBL6937173

Cc1ccc(S(=O)(=O)Oc2ccc(-c3ccc(OS(=O)(=O)c4ccc(C)cc4)cc3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.64
CA12 O43570 2/20 0.64
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
APEX1 P27695 1/20 0.56
ALDH1A1 P00352 3/20 0.53
CA1 P00915 1/20 0.53
CA9 Q16790 1/20 0.53
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
PPARG P37231 1/20 0.52
ENPP3 O14638 3/20 0.51
ENPP1 P22413 3/20 0.51
ENPP2 Q13822 3/20 0.51
LMNA P02545 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL9852204 0.94 MEN1 (0.60) CA2CA12MEN1KMT2AALDH1A1
SCHEMBL18179825 0.94 MEN1 (0.60) CA2CA12MEN1KMT2AALDH1A1
SCHEMBL4126086 0.94 MEN1 (0.60) CA2CA12MEN1KMT2AALDH1A1
SCHEMBL24604538 0.93 CA2 (0.62) CA2CA12MEN1KMT2AAPEX1
SCHEMBL19014762 0.93 CA12 (0.58) CA2CA12MEN1KMT2AAPEX1
SCHEMBL6937794 0.93 CA2 (0.62) CA2CA12MEN1KMT2AAPEX1
Iodide SCHEMBL22068772 0.92 CA2 (0.59) CA2CA12MEN1KMT2AALDH1A1
SCHEMBL17287562 0.91 CA2 (0.57) CA2CA12MEN1KMT2AAPEX1
SCHEMBL17287655 0.91 ENPP3 (0.63) CA2CA12MEN1KMT2AAPEX1
SCHEMBL17287705 0.91 CA2 (0.57) CA2CA12MEN1KMT2AAPEX1

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
EP-1167372-B1 2,2-(Diaryl)vinylphosphine compound, palladium catalyst thereof, and process for producing arylamine, diaryl, or arylalkyne with the catalyst TAKASAGO PERFUMERY CO LTD (JP) 2003-12-10 EP disclosed
US-6455720-B1 AS CATALYSTS TAKASAGO INTERNATIONAL CORPORATION (JP) 2002-09-24 US disclosed
US-20020058837-A1 2,2 (Diarlyl) Vinylphosphine compound, palladium catalyst thereof, and process for producing arylamine, diaryl, or arylalkyne with the catalyst TAKASAGO INTERNATIONAL CORPORATION (JP) 2002-05-16 US disclosed
US-6365776-B1 FROM ORGANOHALOGEN COMPOUND AND AMINE USING PALLADIUM COMPOUND CATALYST AND PROMOTER TAKASAGO INTERNATIONAL CORPORATION (JP) 2002-04-02 US disclosed
US-20020035295-A1 PROCESS FOR PRODUCING AROMATIC AMINES TAKASAGO INTERNATIONAL CORPORATION 2002-03-21 US disclosed
EP-1167372-A1 2,2-(Diaryl)vinylphosphine compound, palladium catalyst thereof, and process for producing arylamine, diaryl, or arylalkyne with the catalyst Takasago International Corporation (JP) 2002-01-02 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 (2 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-20020035295-A1 PROCESS FOR PRODUCING AROMATIC AMINES TYR, DDC, PNMT CA2 3856/4885CA12 4037/4885MEN1 1606/4885
US-20020058837-A1 2,2 (Diarlyl) Vinylphosphine compound, palladium catalyst thereof, and process for producing arylamine, diaryl, or arylalkyne with the catalyst DDT, PDCD11, PLD2 CA2 3780/4885CA12 4431/4885MEN1 2881/4885

“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.