SCHEMBL13386281

SCHEMBL13386281

CC(C)(C)OC(=O)N1CCCN(c2cc(F)c3c(c2)Sc2cc(N4CCOCC4)ccc2N3C(=O)OC(C)(C)C)CC1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 3/20 0.41
▸ PDK2 Q15119 1/20 0.41
▸ MAPT P10636 4/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ LMNA P02545 1/20 0.41
▸ GPR119 Q8TDV5 2/20 0.40
▸ USP30 Q70CQ3 2/20 0.40
▸ SLC6A9 P48067 1/20 0.39
▸ SLC6A5 Q9Y345 1/20 0.39
▸ IDH1 O75874 1/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ USP2 O75604 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ NAMPT P43490 1/20 0.37
▸ TLR9 Q9NR96 1/20 0.37
▸ TLR7 Q9NYK1 1/20 0.37
▸ TGFBR1 P36897 1/20 0.36
▸ BCHE P06276 1/20 0.36

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
SCHEMBL13386133 0.93 BCHE (0.40) PIK3CAMAPTALDH1A1LMNAGPR119
SCHEMBL13386210 0.92 BCHE (0.42) PIK3CAMAPTALDH1A1LMNAGPR119
SCHEMBL13386253 0.88 BACE1 (0.41) PDK2MAPTALDH1A1LMNAGPR119
SCHEMBL13386122 0.85 BCHE (0.39) PIK3CAALDH1A1LMNAGPR119USP30
SCHEMBL13386285 0.84 BCHE (0.39) PIK3CAMAPTALDH1A1LMNAGPR119
SCHEMBL2594780 0.81 PDK2 (0.46) PDK2MAPTALDH1A1LMNAGPR119
SCHEMBL8256409 0.81 MAPT (0.54) PIK3CAPDK2MAPTALDH1A1LMNA
SCHEMBL15909028 0.79 NR1H2 (0.43) PIK3CAMAPTALDH1A1LMNAGPR119
SCHEMBL2585068 0.76 SIRT6 (0.41) PDK2MAPTALDH1A1GPR119BCHE
SCHEMBL5234283 0.76 PDK2 (0.55) PDK2MAPTALDH1A1LMNAGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2699241-B1 ANTIVIRAL COMPOUNDS PROSETTA ANTIVIRAL INC (US) 2016-07-27 — — EP disclosed
US-8828986-B2 Antiviral compounds PROSETTA ANTIVIRAL INC. (US) 2014-09-09 — — US disclosed
EP-2699241-A1 ANTIVIRAL COMPOUNDS Prosetta Antiviral Inc. (US) 2014-02-26 — — EP disclosed
WO-2012145567-A1 ANTIVIRAL COMPOUNDS PROSETTA ANTIVIRAL INC. (US) 2012-10-26 — — WO disclosed
US-20120270854-A1 Antiviral Compounds PROSETTA ANTIVIRAL INC. (US) 2012-10-25 — — 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-20120270854-A1 Antiviral Compounds HAVCR2, MAVS, EIF2AK2 PIK3CA 3381/4885PDK2 1701/4885MAPT 1569/4885

“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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