SCHEMBL3961482

SCHEMBL3961482

O=C(O)NC1CCC(NC(=O)Nc2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 19/20 0.66
▸ USP30 Q70CQ3 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
SCHEMBL12474988 0.88 EPHX2 (0.66) EPHX2USP30
SCHEMBL12474990 0.88 EPHX2 (0.66) EPHX2USP30
SCHEMBL2752048 0.88 EPHX2 (0.71) EPHX2
SCHEMBL4176065 0.87 EPHX2 (0.64) EPHX2USP30
SCHEMBL3345439 0.87 EPHX2 (0.72) EPHX2
SCHEMBL28356482 0.87 EPHX1 (0.74) EPHX2
SCHEMBL28566262 0.86 EPHX2 (0.57) EPHX2
SCHEMBL22719848 0.85 EPHX2 (0.48) EPHX2
SCHEMBL28562963 0.85 EPHX2 (0.62) EPHX2
SCHEMBL28562966 0.85 EPHX2 (0.62) EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210198239-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR PLEXXIKON INC. 2021-07-01 — — US disclosed
WO-2009035928-A1 SOLUBLE EPOXIDE HYDROLASE INHIBITORS ARETE THERAPEUTICS, INC. (US) 2009-03-19 — — 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-20210198239-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR ENTPD5, ADORA2A, ENTPD1 EPHX2 959/4885USP30 4773/4885

“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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