SCHEMBL4261838

SCHEMBL4261838

O=C(Cc1ccccc1)Nc1ccc(OCCCN2CCOCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 17/20 1.00
SMN1; SMN2 Q16637 2/20 0.66
NPC1 O15118 1/20 0.66
HTT P42858 1/20 0.66
RAB9A P51151 1/20 0.66
ALDH1A1 P00352 1/20 0.64
MAPT P10636 1/20 0.64

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
SCHEMBL4265638 0.89 EPHX2 (1.00) EPHX2
SCHEMBL4265223 0.86 EPHX2 (1.00) EPHX2
SCHEMBL4261108 0.86 EPHX2 (1.00) EPHX2
SCHEMBL4256144 0.86 EPHX2 (1.00) EPHX2
SCHEMBL31174709 0.84 EPHX2 (0.79) EPHX2SMN1; SMN2NPC1ALDH1A1
SCHEMBL4014247 0.83 EPHX2 (0.79) EPHX2HTTRAB9AALDH1A1MAPT
SCHEMBL10132916 0.83 SRC (0.72) EPHX2NPC1HTTRAB9A
SCHEMBL10132922 0.83 SRC (0.72) EPHX2NPC1HTTRAB9A
SCHEMBL10132925 0.82 EPHX2 (0.75) EPHX2MAPT
SCHEMBL4620057 0.81 EPHX2 (0.67) EPHX2SMN1; SMN2NPC1RAB9AALDH1A1

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
US-20090023731-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2009-01-22 US claimed
US-20090023731-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2009-01-22 US disclosed
US-20090023731-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2009-01-22 US disclosed
US-20090023731-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. 2009-01-22 US disclosed
WO-2008116145-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-09-25 WO disclosed
WO-2008116145-A2 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2008-09-25 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-20090023731-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS EPHX1, EPHX2, NCEH1 EPHX2 2/4885SMN1; SMN2 4499/4885NPC1 1604/4885

“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.