SCHEMBL18232985

SCHEMBL18232985

CC(C)(C)NC(=O)c1c[nH]c(NC(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.39
▸ APEX1 P27695 1/20 0.39
▸ IMPDH2 P12268 1/20 0.38
▸ SIRT2 Q8IXJ6 1/20 0.38
▸ PRKAB2 O43741 1/20 0.37
▸ PRKAG1 P54619 1/20 0.37
▸ PRKAA2 P54646 1/20 0.37
▸ PRKAA1 Q13131 1/20 0.37
▸ PRKAG3 Q9UGI9 1/20 0.37
▸ PRKAG2 Q9UGJ0 1/20 0.37
▸ PRKAB1 Q9Y478 1/20 0.37
▸ MAPT P10636 2/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ RIPK1 Q13546 1/20 0.35
▸ LMNA P02545 3/20 0.35
▸ HTT P42858 1/20 0.35
▸ HPGDS O60760 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
SCHEMBL18233014 0.79 LMNA (0.47) MAPTLMNA
SCHEMBL18407326 0.77 IMPDH2 (0.38) POLBAPEX1IMPDH2SIRT2PRKAB2
SCHEMBL13701751 0.74 KMT2A (0.48) POLBIMPDH2MEN1KMT2ALMNA
SCHEMBL570284 0.72 MEN1 (0.49) POLBAPEX1IMPDH2SIRT2PRKAB2
SCHEMBL23696115 0.71 KMT2A (0.53) POLBAPEX1MAPTMEN1KMT2A
SCHEMBL22328224 0.69 CREBBP (0.39) POLBAPEX1MEN1KMT2ALMNA
SCHEMBL13475471 0.68 GRN (0.50) POLBAPEX1
SCHEMBL17865779 0.68 LMNA (0.58) POLBSIRT2PRKAB2PRKAG1PRKAA2
SCHEMBL18233007 0.68 ALPL (0.42) POLBAPEX1PRKAB2PRKAG1PRKAA2
SCHEMBL18236154 0.67 BRD4 (0.46) KMT2AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160332996-A1 Hepatitis B Antiviral Agents ENANTA PHARMACEUTICALS, INC. 2016-11-17 — — 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 (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-20160332996-A1 Hepatitis B Antiviral Agents ZC3HAV1, ZC3HAV1L, HAVCR2 POLB 621/4885APEX1 3021/4885IMPDH2 1552/4885

“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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