SCHEMBL24897015

SCHEMBL24897015

CC1(C)OB(c2ccc(-c3cn(CCC(N)=O)nc3C(F)(F)F)c(F)c2F)OC1(C)C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 4/20 0.48
▸ NR1H2 P55055 1/20 0.33
▸ NR1H3 Q13133 1/20 0.33
▸ PDK2 Q15119 2/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ F2 P00734 2/20 0.31
▸ F11 P03951 2/20 0.31
▸ PRSS1 P07477 2/20 0.31
▸ PRSS2 P07478 2/20 0.31
▸ PRSS3 P35030 2/20 0.31
▸ UCHL1 P09936 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
SCHEMBL30192707 1.00 MPO (0.48) MPONR1H2NR1H3PDK2KCNH2
SCHEMBL30384462 0.96 MPO (0.43) MPONR1H2NR1H3KCNH2F2
SCHEMBL24896674 0.96 MPO (0.43) MPONR1H2NR1H3KCNH2F2
SCHEMBL30384451 0.90 MPO (0.46) MPONR1H2NR1H3PDK2F2
SCHEMBL24896670 0.90 MPO (0.46) MPONR1H2NR1H3PDK2F2
SCHEMBL26094499 0.83 IRAK4 (0.32) MPONR1H2NR1H3KCNH2
SCHEMBL24896803 0.83 LRRK2 (0.36) MPONR1H2NR1H3KCNH2
SCHEMBL30384644 0.83 LRRK2 (0.36) MPONR1H2NR1H3KCNH2
SCHEMBL24896806 0.82 MPO (0.34) MPONR1H2NR1H3KCNH2
SCHEMBL30384591 0.82 MPO (0.34) MPONR1H2NR1H3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12421211-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2025-09-23 — — US disclosed
US-20240368117-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2024-11-07 — — US disclosed
CN-118119609-A Imidazole derivatives and their use as antibiotics 豪夫迈·罗氏有限公司 2024-05-31 — — CN disclosed
US-11858912-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2024-01-02 — — US disclosed
US-11858912-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2024-01-02 — — US disclosed
US-11858912-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2024-01-02 — — US disclosed
US-20230133845-A1 NOVEL HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2023-05-04 — — US disclosed
US-20230133845-A1 NOVEL HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2023-05-04 — — US disclosed
US-20230133845-A1 NOVEL HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2023-05-04 — — US disclosed
WO-2023285497-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS ANTIBIOTICS F. HOFFMANN-LA ROCHE AG (CH) 2023-01-19 — — 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 (4 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-11858912-B2 Heterocyclic compounds F12, C1R, MRPL21 MPO 814/4885NR1H2 684/4885NR1H3 840/4885
US-12421211-B2 Heterocyclic compounds F12, C1R, MRPL21 MPO 814/4885NR1H2 684/4885NR1H3 840/4885
US-20230133845-A1 NOVEL HETEROCYCLIC COMPOUNDS F12, PM20D2, XDH MPO 630/4885NR1H2 614/4885NR1H3 788/4885
US-20240368117-A1 HETEROCYCLIC COMPOUNDS F12, C1R, MRPL21 MPO 814/4885NR1H2 684/4885NR1H3 840/4885

“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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