SCHEMBL1734801

SCHEMBL1734801

O=C(O)[C@H](CO)NS(=O)(=O)c1ccccc1Cl

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ITGAV P06756 7/20 0.67
SLC1A3 P43003 1/20 0.59
SLC1A2 P43004 1/20 0.59
SLC1A1 P43005 1/20 0.59
HTT P42858 1/20 0.54
PKLR P30613 1/20 0.54
CTSL P07711 2/20 0.50
CTSS P25774 2/20 0.50
CTSK P43235 2/20 0.50
CTSB P07858 1/20 0.50
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.48
PKM P14618 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
ALDH1A1 P00352 1/20 0.48
BMP1 P13497 1/20 0.47

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
SCHEMBL1734803 1.00 ITGAV (0.67) ITGAVSLC1A3SLC1A2SLC1A1HTT
SCHEMBL8080299 0.87 ITGAV (0.66) ITGAVSLC1A3SLC1A2SLC1A1HTT
SCHEMBL27692486 0.82 ITGAV (0.67) ITGAVSLC1A3SLC1A2SLC1A1PKLR
SCHEMBL7348701 0.79 SLC1A3 (0.61) ITGAVSLC1A3SLC1A2SLC1A1PKLR
SCHEMBL7348707 0.79 SLC1A3 (0.61) ITGAVSLC1A3SLC1A2SLC1A1PKLR
SCHEMBL1734648 0.79 MMP2 (0.60) SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL1734647 0.79 MMP2 (0.60) SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL1734649 0.79 MMP2 (0.60) SLC1A3SLC1A2SLC1A1ALDH1A1
SCHEMBL4621068 0.78 ITGAV (0.70) ITGAVPKLR
SCHEMBL4621521 0.78 ITGAV (0.70) ITGAVPKLR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142533-B1 IMIDAZOLIDINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-11-16 EP disclosed
WO-2011069003-A3 METHODS AND SYSTEMS FOR THE TREATMENT OF ANXIETY DISORDERS AND DISORDERS WITH PSYCHOTIC FEATURES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-10-27 WO disclosed
CN-101641348-A Imidazolidinone derivatives HOFFMANN LA ROCHE CH 2010-02-03 CN disclosed
EP-2142533-A1 IMIDAZOLIDINONE DERIVATIVES F. Hoffmann-Roche AG (CH) 2010-01-13 EP disclosed
US-7625902-B2 Imidazolidinone derivatives HOFFMANN-LA ROCHE INC. (US) 2009-12-01 US disclosed
WO-2008119657-A1 IMIDAZOLIDINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-10-09 WO disclosed
US-20080242677-A1 IMIDAZOLIDINONE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2008-10-02 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-20080242677-A1 IMIDAZOLIDINONE DERIVATIVES NR1H2, NR1H3, NR1I2 ITGAV 2194/4885SLC1A3 3471/4885SLC1A2 3696/4885

“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.