SCHEMBL8180607

SCHEMBL8180607

CC(C)(C)OC(=O)N[C@H]1COCCCCCCC[C@H](B(O)O)NC(=O)[C@@H]2C[C@@H](OC(=O)N3Cc4ccccc4C3)CN2C1=O

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 4/20 0.33
▸ REN P00797 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ CTSD P07339 1/20 0.32
▸ DRD2 P14416 2/20 0.32
▸ BACE1 P56817 1/20 0.32
▸ EPHX2 P34913 1/20 0.31
▸ TERF2 Q15554 1/20 0.31
▸ DPP8 Q6V1X1 2/20 0.30
▸ DPP9 Q86TI2 2/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ DPP4 P27487 1/20 0.30
▸ FAP Q12884 1/20 0.30
▸ DPP7 Q9UHL4 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
SCHEMBL13336392 1.00 NAMPT (0.33) NAMPTRENGAACTSDDRD2
SCHEMBL13573774 0.92 REN (0.35) NAMPTRENDRD2BACE1EPHX2
SCHEMBL26047191 0.92 REN (0.35) NAMPTRENDRD2BACE1EPHX2
SCHEMBL8190835 0.92 REN (0.35) NAMPTRENDRD2BACE1EPHX2
SCHEMBL8194226 0.85 DDB1 (0.36) RENBACE1
SCHEMBL8192438 0.82 FAP (0.34) NAMPTDPP8DPP9DPP4FAP
SCHEMBL13336390 0.81 — —
SCHEMBL8188558 0.81 — —
SCHEMBL13363193 0.81 — —
SCHEMBL13336393 0.80 FAP (0.36) FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100120716-A1 MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS AND USES THEREFOR PHENOMIX CORPORATION (US) 2010-05-13 — — US disclosed
US-20100120716-A1 MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS AND USES THEREFOR PHENOMIX CORPORATION (US) 2010-05-13 — — US disclosed
WO-2008070733-A2 MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS AND USES THEREFOR PHENOMIX CORPORATION (US) 2008-06-12 — — 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-20100120716-A1 MACROCYCLIC HEPATITIS C SERINE PROTEASE INHIBITORS AND USES THEREFOR PREP, HPN, PEPD NAMPT 856/4885REN 938/4885GAA 383/4885

“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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