SCHEMBL1003906

SCHEMBL1003906

O=Cc1ccc(OC2CCN(C(=O)O)CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SRD5A1 P18405 1/20 0.47
SRD5A2 P31213 1/20 0.46
EPHX2 P34913 7/20 0.44
ALDH1A1 P00352 3/20 0.44
KDM4E B2RXH2 1/20 0.44
FAAH O00519 1/20 0.44
PARP10 Q53GL7 1/20 0.43
KMT2A Q03164 1/20 0.41
SCD5 Q86SK9 1/20 0.41
PLA2G1B P04054 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL924473 0.91 SRD5A1 (0.42) SRD5A1SRD5A2EPHX2ALDH1A1KDM4E
SCHEMBL227303 0.87 CYP4F2 (0.49) SRD5A1SRD5A2EPHX2ALDH1A1KDM4E
SCHEMBL6599783 0.84 GAA (0.57) SRD5A1EPHX2ALDH1A1KDM4EKMT2A
SCHEMBL19023394 0.83 EPHX2 (0.45) SRD5A1EPHX2KMT2ASCD5
SCHEMBL15156795 0.83 EPHX2 (0.51) SRD5A1SRD5A2EPHX2ALDH1A1KDM4E
SCHEMBL378262 0.83 HRH3 (0.45) SRD5A1EPHX2ALDH1A1FAAHKMT2A
SCHEMBL213590 0.83 SRD5A1 (0.50) SRD5A1SRD5A2EPHX2ALDH1A1PARP10
SCHEMBL5243542 0.83 SRD5A1 (0.50) SRD5A1SRD5A2EPHX2ALDH1A1KMT2A
SCHEMBL5271411 0.82 EPHX2 (0.59) SRD5A1EPHX2SCD5
SCHEMBL8527326 0.82 HRH3 (0.52)

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-3189059-A2 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS Istituto Europeo di Oncologia S.r.l. (IT) 2017-07-12 EP disclosed
WO-2016034946-A2 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2016-03-10 WO disclosed
US-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-10-27 US disclosed
EP-2271619-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2011-01-12 EP disclosed
WO-2010048149-A2 HETEROCYCLIC MODULATORS OF GPR119 FOR TREATMENT OF DISEASE KALYPSYS, INC. (US) 2010-04-29 WO disclosed
WO-2009126535-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-10-15 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 (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-20110263557-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY GPR119, GPR55, NR1H2 SRD5A1 176/4885SRD5A2 153/4885EPHX2 1379/4885

“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.