SCHEMBL5947972

SCHEMBL5947972

O=C(NCCC(c1cccc(F)c1)c1cccc(F)c1)c1ccnc(O)c1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 13/20 0.53
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ GPR139 Q6DWJ6 1/20 0.43
▸ SLC6A9 P48067 1/20 0.42
▸ SLC6A5 Q9Y345 1/20 0.42
▸ ALOX5 P09917 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
SCHEMBL5947971 0.88 EPHX2 (0.68) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL5947866 0.87 EPHX2 (0.53) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL5947980 0.87 EPHX2 (0.67) EPHX2CYP2C9CYP2C19ALOX5
SCHEMBL5948045 0.86 EPHX2 (0.53) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL5947867 0.85 EPHX2 (0.56) EPHX2CYP2C9CYP2C19ALOX5
SCHEMBL5947956 0.84 EPHX2 (0.63) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL5947888 0.83 EPHX2 (0.62) EPHX2CYP2C9CYP2C19ALOX5
SCHEMBL5947938 0.82 EPHX2 (0.72) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL5947835 0.81 EPHX2 (0.60) EPHX2CYP2C9CYP2C19ALOX5
SCHEMBL5947822 0.80 EPHX2 (0.59) EPHX2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060276515-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-12-07 — — 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-20060276515-A1 Soluble Epoxide Hydrolase Inhibitors and Methods of Using Same EPHX1, EPHX2, NCEH1 EPHX2 2/4885CYP2C9 477/4885CYP2C19 1179/4885

“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.

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