SCHEMBL8190835

SCHEMBL8190835

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

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 1/20 0.35
▸ NAMPT P43490 5/20 0.34
▸ RAMP1 O60894 3/20 0.34
▸ CALCRL Q16602 3/20 0.34
▸ BACE1 P56817 2/20 0.34
▸ DRD2 P14416 2/20 0.33
▸ DDB1 Q16531 1/20 0.32
▸ CRBN Q96SW2 1/20 0.32
▸ ADAM10 O14672 1/20 0.32
▸ MMP1 P03956 1/20 0.32
▸ ERBB2 P04626 1/20 0.32
▸ EPHX2 P34913 1/20 0.32

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
SCHEMBL26047191 1.00 REN (0.35) RENNAMPTRAMP1CALCRLBACE1
SCHEMBL13573774 1.00 REN (0.35) RENNAMPTRAMP1CALCRLBACE1
SCHEMBL8194226 0.92 DDB1 (0.36) RENRAMP1CALCRLBACE1DDB1
SCHEMBL13336392 0.92 NAMPT (0.33) RENNAMPTBACE1DRD2EPHX2
SCHEMBL8180607 0.92 NAMPT (0.33) RENNAMPTBACE1DRD2EPHX2
SCHEMBL8192438 0.87 FAP (0.34) NAMPTADAM10MMP1ERBB2
SCHEMBL5611990 0.85 RAMP1 (0.34) RENNAMPTRAMP1CALCRLBACE1
SCHEMBL8278256 0.85 REN (0.33) RENNAMPTRAMP1CALCRLBACE1
SCHEMBL13886148 0.85 REN (0.33) RENNAMPTRAMP1CALCRLBACE1
SCHEMBL8182060 0.84 FAP (0.34) NAMPTADAM10MMP1ERBB2

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 REN 938/4885NAMPT 856/4885RAMP1 1586/4885

“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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