SCHEMBL6439632

SCHEMBL6439632

CC(C)C1NC(=O)C(C(C)C)NC1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.36
PRKCD Q05655 2/20 0.36
HRH3 Q9Y5N1 1/20 0.35
TSHR P16473 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
MLNR O43193 1/20 0.31
HDAC4 P56524 2/20 0.31
HDAC1 Q13547 2/20 0.31
GAA P10253 1/20 0.31
THRB P10828 1/20 0.31
CTSD P07339 1/20 0.31
PRKD3 O94806 1/20 0.31
PRKCG P05129 1/20 0.31
PRKCB P05771 1/20 0.31
PRKCA P17252 1/20 0.31
PRKCH P24723 1/20 0.31

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
SCHEMBL13399582 1.00 ABCB1 (0.36) ABCB1PRKCDHRH3TSHRALDH1A1
SCHEMBL13290576 1.00 ABCB1 (0.36) ABCB1PRKCDHRH3TSHRALDH1A1
SCHEMBL6439630 1.00 ABCB1 (0.36) ABCB1PRKCDHRH3TSHRALDH1A1
SCHEMBL18751776 1.00 ABCB1 (0.36) ABCB1PRKCDHRH3TSHRALDH1A1
SCHEMBL13290575 1.00 ABCB1 (0.36) ABCB1PRKCDHRH3TSHRALDH1A1
SCHEMBL13399581 1.00 ABCB1 (0.36) ABCB1PRKCDHRH3TSHRALDH1A1
SCHEMBL16431637 0.87 TSHR (0.41) TSHRHDAC4HDAC1
SCHEMBL19696332 0.85 PRKCD (0.31) ABCB1PRKCDHRH3CTSD
SCHEMBL4402045 0.82 HRH3 (0.40) PRKCDHRH3MLNRHDAC4HDAC1
SCHEMBL15762029 0.82 HRH3 (0.40) PRKCDHRH3MLNRHDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115536598-B New synthesis method of 1, 4-dimethyl-2, 5-piperazine dione compound 青岛科技大学 2024-04-02 CN claimed
CN-119684192-A Method for forming ring of complex monomer 中国科学院长春应用化学研究所 2025-03-25 CN disclosed
WO-2024126857-A1 SYNTHESIS OF POLY(AMINO ACIDS) UNIVERSITY OF LEEDS (GB) 2024-06-20 WO disclosed
CN-115536598-B New synthesis method of 1, 4-dimethyl-2, 5-piperazine dione compound 青岛科技大学 2024-04-02 CN disclosed
CN-117603178-A Two anti-inflammatory compounds extracted from herba Alternantherae Alternifolia, and extraction method and application thereof 国药集团同济堂(贵州)制药有限公司 2024-02-27 CN disclosed
CN-117603178-A Two anti-inflammatory compounds extracted from herba Alternantherae Alternifolia, and extraction method and application thereof 国药集团同济堂(贵州)制药有限公司 2024-02-27 CN disclosed
EP-3443054-B1 PROCESS FOR PRODUCING A COMBUSTIBLE PRODUCT INDUSTRIAL CHEMICALS GROUP LTD (GB) 2020-01-29 EP disclosed
EP-2629889-B1 RUTHENIUM COMPLEXES AND THEIR USES IN PROCESSES FOR FORMATION AND/OR HYDROGENATION OF ESTERS, AMIDES AND DERIVATIVES THEREOF YEDA RES & DEV (IL) 2019-04-03 EP disclosed
US-9840479-B2 Polyamine-fatty acid derived lipidoids and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-12-12 US disclosed
EP-3231856-A1 COMBUSTIBLE PRODUCT Industrial Chemicals Group Limited (GB) 2017-10-18 EP disclosed
US-9738685-B2 Use of ruthenium complexes for preparing amides, polypeptides and cyclic dipeptides YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2017-08-22 US disclosed
CN-106680395-A Method for measuring content of protocatechuic acid in jasminum elongatum 广东省第二中医院(广东省中医药工程技术研究院) 2017-05-17 CN disclosed
US-20170107251-A1 NOVEL RUTHENIUM COMPLEXES AND THEIR USES IN PROCESSES FOR FORMATION AND/OR HYDROGENATION OF ESTERS, AMIDES AND DERIVATIVES THEREOF YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2017-04-20 US disclosed
CN-106148133-A A kind of health promoting wine and preparation method thereof 邱海莲 2016-11-23 CN disclosed
US-20160002178-A1 POLYAMINE-FATTY ACID DERIVED LIPIDOIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2016-01-07 US disclosed
US-20110295006-A1 CYCLIC DIPEPTIDES AS FEED ADDITIVES EVONIK DEGUSSA GMBH (DE) 2011-12-01 US disclosed
US-20110295006-A1 CYCLIC DIPEPTIDES AS FEED ADDITIVES EVONIK DEGUSSA GMBH (DE) 2011-12-01 US disclosed
US-20100022559-A1 BISOXIMES AS FUNGICIDES BAYER CROPSCIENCE AG (DE) 2010-01-28 US disclosed
US-20050077648-A1 Solution casting method and polymer film FUJIFILM CORPORATION (JP) 2005-04-14 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 (4 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-20110295006-A1 CYCLIC DIPEPTIDES AS FEED ADDITIVES VIP, AADAT, ARGLU1 ABCB1 4510/4885PRKCD 1344/4885HRH3 132/4885
US-20170107251-A1 NOVEL RUTHENIUM COMPLEXES AND THEIR USES IN PROCESSES FOR FORMATION AND/OR HYDROGENATION OF ESTERS, AMIDES AND DERIVATIVES THEREOF ADH1C, ADH5, ADH1A ABCB1 4862/4885PRKCD 237/4885HRH3 10/4885
US-20100022559-A1 BISOXIMES AS FUNGICIDES DDT, FHIT, CYP4X1 ABCB1 2099/4885PRKCD 4316/4885HRH3 2521/4885
US-20160002178-A1 POLYAMINE-FATTY ACID DERIVED LIPIDOIDS AND USES THEREOF SGMS2, SGMS1, ARG2 ABCB1 2208/4885PRKCD 969/4885HRH3 408/4885

“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.