SCHEMBL1734747

SCHEMBL1734747

CCCS(=O)(=O)N1C[C@@H](C(=O)N2CCN(c3cc(C)ccc3C)CC2)N(c2ccccc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
CYP2C9 P11712 2/20 0.45
CYP2C19 P33261 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 10/20 0.45
TP53 P04637 3/20 0.45
LMNA P02545 6/20 0.44
ALDH1A1 P00352 4/20 0.44
NR4A1 P22736 1/20 0.44
ESR2 Q92731 1/20 0.44
HTT P42858 4/20 0.43
OPRK1 P41145 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.42
NPSR1 Q6W5P4 2/20 0.42
USP2 O75604 4/20 0.41
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL1736870 0.95 MAPT (0.44) TSHRMEN1KMT2ACYP2C9CYP2C19
SCHEMBL1736867 0.95 MAPT (0.44) TSHRMEN1KMT2ACYP2C9CYP2C19
SCHEMBL1734819 0.90 MAPT (0.44) TSHRMEN1KMT2ACYP2C9CYP2C19
SCHEMBL1734815 0.90 MAPT (0.44) TSHRMEN1KMT2ACYP2C9CYP2C19
SCHEMBL1735660 0.89 MAPT (0.47) TSHRMEN1KMT2ACYP2C9CYP2C19
SCHEMBL1735837 0.86 MAPT (0.52) TSHRMEN1KMT2ACYP2C9CYP2C19
SCHEMBL1734775 0.86 MAPT (0.52) TSHRMEN1KMT2ACYP2C9CYP2C19
SCHEMBL1734779 0.86 MAPT (0.52) TSHRMEN1KMT2ACYP2C9CYP2C19
SCHEMBL1734698 0.86 MAPT (0.47) TSHRMEN1KMT2ACYP2C9CYP2C19
SCHEMBL1734699 0.86 MAPT (0.47) TSHRMEN1KMT2ACYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142533-B1 IMIDAZOLIDINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-11-16 EP claimed
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 claimed
EP-2142533-A1 IMIDAZOLIDINONE DERIVATIVES F. Hoffmann-Roche AG (CH) 2010-01-13 EP claimed
US-7625902-B2 Imidazolidinone derivatives HOFFMANN-LA ROCHE INC. (US) 2009-12-01 US claimed
WO-2008119657-A1 IMIDAZOLIDINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-10-09 WO claimed
US-20080242677-A1 IMIDAZOLIDINONE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2008-10-02 US claimed
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
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 TSHR 197/4885MEN1 2714/4885KMT2A 2144/4885

“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.