SCHEMBL3946296

SCHEMBL3946296

O=C(Nc1ccc(F)cc1)Nc1ccc(C(=O)N2CCOCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 8/20 1.00
HPGD P15428 3/20 0.70
SMN1; SMN2 Q16637 2/20 0.67
ALDH1A1 P00352 2/20 0.65
HTT P42858 2/20 0.65
LMNA P02545 2/20 0.65
NPC1 O15118 1/20 0.65
MAPT P10636 1/20 0.65
TP53 P04637 1/20 0.65
KDM4E B2RXH2 2/20 0.62
NAMPT P43490 1/20 0.59
PIK3CA P42336 1/20 0.58
MTOR P42345 1/20 0.58
PIK3CG P48736 1/20 0.58

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
SCHEMBL5208543 0.88 EPHX2 (0.77) EPHX2HPGDSMN1; SMN2ALDH1A1HTT
SCHEMBL3944093 0.87 EPHX2 (0.77) EPHX2HPGDSMN1; SMN2ALDH1A1HTT
SCHEMBL3937303 0.86 EPHX2 (0.77) EPHX2HPGDSMN1; SMN2ALDH1A1HTT
SCHEMBL4921355 0.86 HPGD (0.81) EPHX2HPGDSMN1; SMN2ALDH1A1HTT
SCHEMBL3939273 0.85 EPHX2 (1.00) EPHX2HPGDSMN1; SMN2ALDH1A1HTT
SCHEMBL14029874 0.84 EPHX2 (0.72) EPHX2HPGDSMN1; SMN2ALDH1A1HTT
SCHEMBL8172365 0.83 EPHX2 (0.71) EPHX2HPGDNPC1KDM4E
SCHEMBL3944127 0.83 EPHX2 (1.00) EPHX2HTTNPC1MAPTNAMPT
SCHEMBL28284715 0.82 EPHX2 (0.69) EPHX2HPGDSMN1; SMN2ALDH1A1HTT
SCHEMBL3936504 0.82 EPHX2 (1.00) EPHX2HPGDSMN1; SMN2ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101495119-A Soluble epoxide hydrolase inhibitors ARETE THERAPEUTICS INC (US) 2009-07-29 CN claimed
EP-2046329-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS Arete Therapeutics, INC. (US) 2009-04-15 EP claimed
US-20080032978-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-02-07 US claimed
WO-2008016884-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-02-07 WO claimed
CN-101495119-A Soluble epoxide hydrolase inhibitors ARETE THERAPEUTICS INC (US) 2009-07-29 CN disclosed
EP-2046329-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS Arete Therapeutics, INC. (US) 2009-04-15 EP disclosed
WO-2008016884-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-02-07 WO disclosed
US-20080032978-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-02-07 US disclosed
US-20080032978-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-02-07 US disclosed
WO-2008016884-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-02-07 WO disclosed
US-20080032978-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2008-02-07 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-20080032978-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS EPHX1, EPHX2, NCEH1 EPHX2 2/4885HPGD 97/4885SMN1; SMN2 4512/4885

“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.