SCHEMBL3508922

SCHEMBL3508922

CC(C)(O[Si](C)(C)C(C)(C)C)c1ccc(B2OC(C)(C)C(C)(C)O2)cn1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 2/20 0.44
▸ LPL P06858 11/20 0.36
▸ LIPG Q9Y5X9 11/20 0.36
▸ USP30 Q70CQ3 1/20 0.36
▸ FFAR1 O14842 1/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ AAK1 Q2M2I8 1/20 0.34

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
SCHEMBL30227360 0.90 DGAT1 (0.47) DGAT1LPLLIPGUSP30FFAR1
SCHEMBL15001246 0.90 DGAT1 (0.47) DGAT1LPLLIPGUSP30FFAR1
SCHEMBL155003 0.90 DGAT1 (0.47) DGAT1LPLLIPGUSP30FFAR1
SCHEMBL15001206 0.84 DGAT1 (0.43) DGAT1LPLLIPGUSP30FFAR1
SCHEMBL19470372 0.81 DGAT1 (0.39) DGAT1LPLLIPGUSP30FFAR1
SCHEMBL15001186 0.81 DGAT1 (0.48) DGAT1LPLLIPGUSP30FFAR1
SCHEMBL16272832 0.81 DGAT1 (0.48) DGAT1LPLLIPGUSP30FFAR1
SCHEMBL21721888 0.80 DGAT1 (0.50) DGAT1LPLLIPGUSP30FFAR1
SCHEMBL31753409 0.80 FFAR1 (0.35) DGAT1LPLLIPGFFAR1CA1
SCHEMBL16009725 0.80 FFAR1 (0.35) DGAT1LPLLIPGFFAR1CA1

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
WO-2017167994-A1 FUSED PENTACYCLIC IMIDAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2017-10-05 — — WO disclosed
WO-2017167995-A1 FUSED HEXACYCLIC IMIDAZOLE DERIVATIVES AS MODULATORS OF TNF ACTIVITY UCB BIOPHARMA SPRL (BE) 2017-10-05 — — WO disclosed
US-8367706-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-02-05 — — US disclosed
US-8367706-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-02-05 — — US disclosed
US-8367706-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-02-05 — — US disclosed
EP-2166846-B1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME (US) 2012-10-17 — — EP disclosed
US-20100256097-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2010-10-07 — — US disclosed
US-20100256097-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2010-10-07 — — US disclosed
EP-2166846-A1 INHIBITORS OF JANUS KINASES Merck Sharp & Dohme Corp. (US) 2010-03-31 — — EP disclosed
WO-2008156726-A1 INHIBITORS OF JANUS KINASES MERCK & CO., INC. (US) 2008-12-24 — — 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-20100256097-A1 INHIBITORS OF JANUS KINASES JAK2, JAK3, JAK1 DGAT1 2705/4885LPL 3758/4885LIPG 4127/4885

“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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