SCHEMBL1486014

SCHEMBL1486014

O=S(=O)(O)c1cccc2[c][c]ccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.44
AURKA O14965 1/20 0.36
AURKB Q96GD4 1/20 0.36
CYP1A2 P05177 3/20 0.36
COMT P21964 1/20 0.33
SNCA P37840 2/20 0.32
CHAT P28329 1/20 0.32
MYC P01106 1/20 0.32
MEN1 O00255 1/20 0.31
NSD2 O96028 1/20 0.31
POLB P06746 1/20 0.31
IDE P14735 1/20 0.31
DUSP3 P51452 1/20 0.31
CCR6 P51684 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
CDK2 P24941 2/20 0.31
MPL P40238 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL1807070 0.76 TTR (0.50) TTRAURKAAURKBCYP1A2COMT
SCHEMBL2689003 0.76 MPL (0.38) TTRAURKAAURKBCYP1A2COMT
SCHEMBL6635201 0.71 TTR (0.44) TTRAURKAAURKBCYP1A2COMT
SCHEMBL8747432 0.71 TTR (0.44) TTRAURKAAURKBCYP1A2COMT
SCHEMBL29363198 0.71 TTR (0.75) TTRAURKAAURKBCYP1A2COMT
SCHEMBL30233642 0.71 TTR (0.75) TTRAURKAAURKBCYP1A2COMT
SCHEMBL6242 0.71 TTR (0.75) TTRAURKAAURKBCYP1A2COMT
SCHEMBL1804225 0.70 TTR (0.43) TTRAURKAAURKBCYP1A2COMT
SCHEMBL8659138 0.70 TTR (0.51) TTRAURKAAURKBCYP1A2COMT
SCHEMBL7482596 0.70 TTR (0.43) TTRAURKAAURKBCYP1A2COMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130131112-A1 SALTS OF 3-(4-AMINO-1-OXO-1,3-DIHYDRO-ISOINDOL-2-YL)PIPERIDINE-2,6-DIONE AND DERIVATIVES THEREOF, OR POLYMORPHS OF SALTS, PROCESS FOR PREPARING SAME AND USE THEREOF TIANJIN MICHELE SCI-TECH DEVELOPMENT CO., LTD (CN) 2013-05-23 US disclosed
US-20110060010-A1 SALTS OF 3-(4-AMINO-1-OXO-1,3-DIHYDRO-ISOINDOL-2-YL)PIPERIDINE-2,6-DIONE AND DERIVATIVES THEREOF, OR POLYMORPHS OF SALTS, PROCESS FOR PREPARING SAME AND USE THEREOF TIANJIN HEMAY BIO-TECH CO., LTD (CN) 2011-03-10 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 (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-20130131112-A1 SALTS OF 3-(4-AMINO-1-OXO-1,3-DIHYDRO-ISOINDOL-2-YL)PIPERIDINE-2,6-DIONE AND DERIVATIVES THEREOF, OR POLYMORPHS OF SALTS, PROCESS FOR PREPARING SAME AND USE THEREOF AQP1, IDO1, PGF TTR 2877/4885AURKA 2463/4885AURKB 3430/4885
US-20110060010-A1 SALTS OF 3-(4-AMINO-1-OXO-1,3-DIHYDRO-ISOINDOL-2-YL)PIPERIDINE-2,6-DIONE AND DERIVATIVES THEREOF, OR POLYMORPHS OF SALTS, PROCESS FOR PREPARING SAME AND USE THEREOF AQP1, IDO1, PGF TTR 2877/4885AURKA 2463/4885AURKB 3430/4885

“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.