SCHEMBL3605088

SCHEMBL3605088

N#Cc1cccc(OC2CCN(C(=O)O)CC2)c1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.59
MGLL Q99685 11/20 0.57
SLC6A2 P23975 1/20 0.53
SLC6A4 P31645 1/20 0.53
SLC6A3 Q01959 1/20 0.53
HRH1 P35367 4/20 0.50
CCR3 P51677 4/20 0.50
CNR1 P21554 1/20 0.49
CHRM4 P08173 1/20 0.48
GPR119 Q8TDV5 1/20 0.46

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
SCHEMBL14834114 0.93 SLC6A2 (0.57) EPHX2MGLLSLC6A2SLC6A4SLC6A3
SCHEMBL21824824 0.92 MGLL (0.55) EPHX2MGLLSLC6A2SLC6A4SLC6A3
SCHEMBL2636481 0.86 EPHX2 (0.56) EPHX2MGLLSLC6A2SLC6A4SLC6A3
SCHEMBL14834074 0.86 SLC6A2 (0.55) EPHX2MGLLSLC6A2SLC6A4SLC6A3
SCHEMBL14834077 0.86 SLC6A2 (0.55) EPHX2MGLLSLC6A2SLC6A4SLC6A3
SCHEMBL14834233 0.86 SLC6A2 (0.55) EPHX2MGLLSLC6A2SLC6A4SLC6A3
SCHEMBL4555874 0.85 GPR119 (0.60) EPHX2MGLLGPR119
SCHEMBL2636485 0.85 EPHX2 (0.57) EPHX2MGLLSLC6A2SLC6A4SLC6A3
SCHEMBL2454389 0.84 GPR119 (0.49) EPHX2MGLLHRH1CCR3CNR1
SCHEMBL3290157 0.83 HRH3 (0.64) EPHX2GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723331-B2 Thienopyrimidine compounds and uses thereof ASTRAZENECA AB (SE) 2010-05-25 US disclosed
US-20090111791-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-04-30 US disclosed
EP-1996545-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHODS OF USING SAME Boehringer Ingelheim International GmbH (DE) 2008-12-03 EP disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US disclosed
WO-2007106705-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS AND METHODS OF USING SAME BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-09-20 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-20080051405-A1 Therapeutic Agents GPR119, HTT, IAPP EPHX2 1731/4885MGLL 509/4885SLC6A2 1701/4885
US-20090111791-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same EPHX1, EPHX2, NCEH1 EPHX2 2/4885MGLL 107/4885SLC6A2 3656/4885

“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.