SCHEMBL1711979

SCHEMBL1711979

C=CCOCC(=O)c1cccc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.49
FEN1 P39748 1/20 0.49
PARP1 P09874 1/20 0.45
GAA P10253 3/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 1/20 0.40
HTT P42858 1/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
IDO1 P14902 2/20 0.39
CXCR3 P49682 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL967567 0.82 TDP1 (0.48) PARP1GAAMEN1KMT2AALDH1A1
SCHEMBL1712196 0.81 GSK3B (0.48) ERCC5FEN1GAATSHRMEN1
SCHEMBL1712729 0.80 TDP1 (0.47) ERCC5FEN1MEN1KMT2AALDH1A1
SCHEMBL220454 0.79 ERCC5 (0.49) ERCC5FEN1PARP1GAAMEN1
SCHEMBL1882737 0.78 CYP3A4 (0.53) ERCC5FEN1PARP1GAATSHR
SCHEMBL6499526 0.76 ERCC5 (0.53) ERCC5FEN1PARP1GAAMEN1
SCHEMBL9991305 0.76 ERCC5 (0.53) ERCC5FEN1PARP1GAAMEN1
SCHEMBL4888739 0.76 GRM5 (0.54) ERCC5FEN1PARP1GAAMEN1
SCHEMBL3869644 0.76 ERCC5 (0.56) ERCC5FEN1PARP1GAAMEN1
SCHEMBL10514397 0.75 GAA (0.50) GAATSHRMEN1KMT2AMAPT

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-2344460-B1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AKASHI THERAPEUTICS INC (US) 2015-08-12 EP disclosed
US-8383608-B2 Imidazolidine compounds as androgen receptor modulators DART THERAPEUTICS LLC 2013-02-26 US disclosed
US-20120178718-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AKASHI THERAPEUTICS, INC. 2012-07-12 US disclosed
EP-2344460-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS Galapagos N.V. (BE) 2011-07-20 EP disclosed
US-7968581-B2 Imidazolidine compounds as androgen receptor modulators GALAPAGOS NV (BE) 2011-06-28 US disclosed
US-20100113547-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AKASHI THERAPEUTICS, INC. 2010-05-06 US disclosed
WO-2010029119-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS GALAPAGOS NV (BE) 2010-03-18 WO 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-20120178718-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, GNRHR ERCC5 3695/4885FEN1 4185/4885PARP1 4004/4885
US-20100113547-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, GNRHR ERCC5 3713/4885FEN1 4039/4885PARP1 4020/4885

“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.