SCHEMBL2458394

SCHEMBL2458394

NC(=O)On1nnc2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 4/20 0.58
HDAC3 O15379 3/20 0.57
HDAC4 P56524 3/20 0.57
HDAC1 Q13547 3/20 0.57
HDAC7 Q8WUI4 3/20 0.57
HDAC2 Q92769 3/20 0.57
HDAC10 Q969S8 3/20 0.57
HDAC11 Q96DB2 3/20 0.57
HDAC8 Q9BY41 3/20 0.57
HDAC6 Q9UBN7 3/20 0.57
HDAC9 Q9UKV0 3/20 0.57
HDAC5 Q9UQL6 3/20 0.57
MGAM O43451 4/20 0.50
AMY1A P0DUB6 4/20 0.50
GAA P10253 4/20 0.50
SI P14410 4/20 0.50
MGAM2 Q2M2H8 4/20 0.50
F2 P00734 1/20 0.50
HPGD P15428 1/20 0.50
SLC9A1 P19634 1/20 0.50

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
SCHEMBL29773981 0.86 SIRT2 (0.61) SIRT2HDAC3HDAC4HDAC1HDAC7
SCHEMBL39113 0.86 SIRT2 (0.61) SIRT2HDAC3HDAC4HDAC1HDAC7
SCHEMBL1562975 0.86 SIRT2 (0.61) SIRT2HDAC3HDAC4HDAC1HDAC7
SCHEMBL30140830 0.84 SIRT2 (0.60) SIRT2HDAC3HDAC4HDAC1HDAC7
SCHEMBL26598951 0.84 SIRT2 (0.60) SIRT2HDAC3HDAC4HDAC1HDAC7
SCHEMBL239516 0.84 SIRT2 (0.60) SIRT2HDAC3HDAC4HDAC1HDAC7
SCHEMBL8768478 0.83 SIRT2 (0.56) SIRT2HDAC3HDAC4HDAC1HDAC7
SCHEMBL23920659 0.83 SIRT2 (0.51) SIRT2HDAC3HDAC4HDAC1HDAC7
SCHEMBL10299926 0.83 SIRT2 (0.58) SIRT2HDAC3HDAC4HDAC1HDAC7
SCHEMBL20445470 0.83 SIRT2 (0.58) SIRT2HDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10954474-B2 Leuco polymers as bluing agents in laundry care compositions MILLIKEN & COMPANY (US) 2021-03-23 US disclosed
US-10472595-B2 Leuco polymers as bluing agents in laundry care compositions THE PROCTER & GAMBLE COMPANY (US) 2019-11-12 US disclosed
US-10385294-B2 Leuco polymers as bluing agents in laundry care compositions THE PROCTER & GAMBLE COMPANY (US) 2019-08-20 US disclosed
US-10351709-B2 Leuco polymers as bluing agents in laundry care compositions MILLIKEN & COMPANY (US) 2019-07-16 US disclosed
US-20180119063-A1 LEUCO POLYMERS AS BLUING AGENTS IN LAUNDRY CARE COMPOSITIONS THE PROCTER & GAMBLE COMPANY 2018-05-03 US disclosed
US-20180119062-A1 LEUCO POLYMERS AS BLUING AGENTS IN LAUNDRY CARE COMPOSITIONS THE PROCTER & GAMBLE COMPANY 2018-05-03 US disclosed
US-20180118946-A1 LEUCO POLYMERS AS BLUING AGENTS IN LAUNDRY CARE COMPOSITIONS MILLIKEN & COMPANY 2018-05-03 US disclosed
US-20140045241-A1 MICELLAR POLYSILOXANE ENZYME IMMOBILIZATION MATERIALS AKERMIN, INC. (US) 2014-02-13 US disclosed
WO-2012122404-A2 MICELLAR POLYSILOXANE ENZYME IMMOBILIZATION MATERIALS AKERMIN, INC. (US) 2012-09-13 WO disclosed
EP-2046733-B1 PROCESS FOR THE PREPARATION OF EPSILON-ALKOXYCARBONYLLYSINES AND THEIR ANALOGUES ITALIANA SINT SPA (IT) 2011-10-05 EP disclosed
US-8026372-B2 Process for the preparation of ε-alkoxycarbonyllysines and their analogues F.I.S. FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2011-09-27 US disclosed
US-20090312557-A1 PROCESS FOR THE PREPARATION OF EPSILON -ALKOXYCARBONYLLYSINES AND THEIR ANALOGUES F.I.S. FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2009-12-17 US disclosed
EP-2046733-A1 PROCESS FOR THE PREPARATION OF EPSILON-ALKOXYCARBONYLLYSINES AND THEIR ANALOGUES F.I.S. FABBRICA ITALIANA SINTETICI S.P.A. (IT) 2009-04-15 EP disclosed
WO-2008014811-A1 PROCESS FOR THE PREPARATION OF ε-ALKOXYCARBONYLLYSINES AND THEIR ANALOGUES F.I.S. FABBRICA ITALIANA SINTETICI S.P.A (IT) 2008-02-07 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-20090312557-A1 PROCESS FOR THE PREPARATION OF EPSILON -ALKOXYCARBONYLLYSINES AND THEIR ANALOGUES AADAT, ALKBH3, BCAT2 SIRT2 2087/4885HDAC3 1319/4885HDAC4 2509/4885

“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.