SCHEMBL25836597

SCHEMBL25836597

Cc1c(Br)ccc(OC(=O)OC(C)(C)C)c1C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.40
▸ GRM6 O15303 1/20 0.37
▸ BRD4 O60885 2/20 0.34
▸ CA2 P00918 2/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ CA14 Q9ULX7 1/20 0.33
▸ AAK1 Q2M2I8 3/20 0.32
▸ MTNR1A P48039 1/20 0.32
▸ MTNR1B P49286 1/20 0.32
▸ CISD2 Q8N5K1 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ NCEH1 Q6PIU2 1/20 0.31
▸ KDM1A O60341 1/20 0.31

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
SCHEMBL31006018 0.87 ELANE (0.41) ELANEGRM6BRD4CA2CA12
SCHEMBL18857950 0.87 ELANE (0.41) ELANEGRM6BRD4CA2CA12
SCHEMBL25836596 0.79 ELANE (0.37) ELANEGRM6BRD4CA2CISD2
SCHEMBL18675818 0.78 MTNR1A (0.39) ELANEGRM6CA2CA12CA1
SCHEMBL15867211 0.77 GRM6 (0.40) GRM6CA2CA12CA1CA9
SCHEMBL31617775 0.77 ELANE (0.40) ELANEGRM6CA2CA12CA1
SCHEMBL18089428 0.77 ELANE (0.40) ELANEBRD4CA2CA12CA1
SCHEMBL30755354 0.76 GRM6 (0.42) GRM6MTNR1AMTNR1BCISD2CYP2C9
SCHEMBL27380064 0.76 GRM6 (0.42) GRM6MTNR1AMTNR1BCISD2CYP2C9
SCHEMBL18857968 0.75 KMT2A (0.37) ELANEBRD4CA9AAK1NPSR1

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-20230287009-A1 OXO-SUBSTITUTED COMPOUND Sumitomo Pharma Co., Ltd. (JP) 2023-09-14 — — US disclosed
US-11702431-B2 Oxo-substituted compound Sumitomo Pharma Co., Ltd. (JP) 2023-07-18 — — 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 (2 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-11702431-B2 Oxo-substituted compound CYP51A1, OXA1L, O60361 ELANE 359/4885GRM6 4086/4885BRD4 2396/4885
US-20230287009-A1 OXO-SUBSTITUTED COMPOUND CYP51A1, OXA1L, O60361 ELANE 359/4885GRM6 4086/4885BRD4 2396/4885

“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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