SCHEMBL5947971

SCHEMBL5947971

O=C(NCCC(c1ccccc1)c1ccccc1)c1ccnc(O)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 11/20 0.68
▸ CYP2C9 P11712 1/20 0.60
▸ CYP2C19 P33261 1/20 0.60
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ LMNA P02545 1/20 0.55
▸ HPGD P15428 1/20 0.55
▸ MTNR1A P48039 1/20 0.50
▸ MTNR1B P49286 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ MAPT P10636 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ CNR1 P21554 1/20 0.49
▸ CNR2 P34972 1/20 0.49
▸ PSEN1 P49768 1/20 0.48
▸ PSEN2 P49810 1/20 0.48
▸ APH1B Q8WW43 1/20 0.48
▸ NCSTN Q92542 1/20 0.48
▸ APH1A Q96BI3 1/20 0.48

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
SCHEMBL5947625 0.88 EPHX2 (0.53) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL5947980 0.88 EPHX2 (0.67) EPHX2CYP2C9CYP2C19
SCHEMBL5947972 0.88 EPHX2 (0.53) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL5948045 0.88 EPHX2 (0.53) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL5213128 0.86 EPHX2 (0.71) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL5947676 0.85 EPHX2 (0.67) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL4619467 0.85 EPHX2 (0.67) EPHX2CYP2C9CYP2C19MEN1KMT2A
SCHEMBL5947867 0.83 EPHX2 (0.56) EPHX2CYP2C9CYP2C19
SCHEMBL5947835 0.82 EPHX2 (0.60) EPHX2CYP2C9CYP2C19
SCHEMBL5947822 0.81 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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