SCHEMBL22931773

SCHEMBL22931773

COc1cnc(N(C(=O)OC(C)(C)C)c2ccc(C(F)(F)F)cc2)c(-c2noc(=O)[nH]2)n1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LIPE Q05469 1/20 0.33
▸ RARB P10826 1/20 0.31
▸ TRPM8 Q7Z2W7 1/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ MT-CO2 P00403 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC8 Q9BY41 1/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ CACNA1G O43497 1/20 0.30
▸ CACNA1B Q00975 1/20 0.30
▸ CACNA1C Q13936 1/20 0.30
▸ ABCG2 Q9UNQ0 1/20 0.30
▸ MDM2 Q00987 1/20 0.30

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
SCHEMBL22932338 0.83 CNR1 (0.32) RARBCNR1HDAC1HDAC8HDAC6
SCHEMBL24755068 0.83 CACNA1H (0.32) TRPM8HDAC1HDAC8HDAC6CACNA1B
SCHEMBL22931785 0.79 ABL1 (0.33) RARBCNR1HDAC1HDAC8HDAC6
SCHEMBL22931772 0.77 LIPE (0.37) LIPEMT-CO2CACNA1GCACNA1BCACNA1C
SCHEMBL29806156 0.77 LIPE (0.37) LIPEMT-CO2CACNA1GCACNA1BCACNA1C
SCHEMBL22931767 0.74 EPHX2 (0.37) —
SCHEMBL29806705 0.73 LIPE (0.35) LIPEMT-CO2HDAC1HDAC6ABCG2
SCHEMBL24755009 0.73 LIPE (0.35) LIPEMT-CO2HDAC1HDAC6ABCG2
SCHEMBL22932193 0.72 EPHX2 (0.37) —
SCHEMBL29420795 0.72 EPHX2 (0.37) —

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-20220402900-A1 1,2,4-OXADIAZOL-5-ONE DERIVATIVES FOR THE TREATMENT OF CANCER BASILEA PHARM INT AG (CH) 2022-12-22 — — US disclosed
WO-2021018869-A1 1,2,4-OXADIAZOL-5-ONE DERIVATIVES FOR THE TREATMENT OF CANCER Basilea Pharmaceutica International AG (CH) 2021-02-04 — — 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-20220402900-A1 1,2,4-OXADIAZOL-5-ONE DERIVATIVES FOR THE TREATMENT OF CANCER OXER1, CBR3, CCNY LIPE 4733/4885RARB 696/4885TRPM8 4081/4885

“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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