SCHEMBL426581

SCHEMBL426581

[CH2]C(=O)N1CCN(CC)CC1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.50
KDM4E B2RXH2 5/20 0.47
ALDH1A1 P00352 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL772774 0.92 HSD11B1 (0.49) HSD11B1KDM4E
SCHEMBL4910788 0.82 HRH3 (0.43) ALDH1A1SMN1; SMN2KMT2A
SCHEMBL22163998 0.80 HSD11B1 (0.53) HSD11B1KDM4EALDH1A1SMN1; SMN2
SCHEMBL1196794 0.79
SCHEMBL4910222 0.79 GPR183 (0.46) KDM4EALDH1A1TDP1SMN1; SMN2
SCHEMBL2748651 0.78 KDM4E (0.53) HSD11B1KDM4EALDH1A1TDP1
SCHEMBL84934 0.78 PIK3CD (0.59) HSD11B1KDM4ETDP1
SCHEMBL1435236 0.77 GPR183 (0.49) HSD11B1KDM4EALDH1A1TDP1SMN1; SMN2
SCHEMBL772617 0.77 HSD11B1 (0.51) HSD11B1KDM4EALDH1A1MEN1RAB9A
SCHEMBL4914337 0.77 GNAI3 (0.48)

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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113966325-A Fluorine-containing substituted imidazole salt compound, preparation method thereof, medicinal composition and application thereof 厦门华绰生物医药科技有限公司 2022-01-21 CN claimed
CN-111909092-A Fluorine-containing substituted imidazole salt compound, preparation method thereof, medicinal composition and application thereof 厦门华绰生物医药科技有限公司 2020-11-10 CN claimed
CN-110612288-A Substituted imidazole salt compound, preparation method thereof, medicinal composition and application thereof 厦门华绰生物医药科技有限公司 2019-12-24 CN claimed
CN-101490058-A Antiviral agents GENELABS TECH INC (US) 2009-07-22 CN claimed
EP-2044083-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2009-04-08 EP claimed
WO-2008008912-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2008-01-17 WO claimed
WO-2008008907-A2 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2008-01-17 WO claimed
CN-101103026-A Bicyclic heteroaryl derivatives for treating viruses GENELABS INC (US) 2008-01-09 CN claimed
EP-1844042-A1 INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2007-10-17 EP claimed
US-20060211698-A1 Bicyclic heteroaryl derivatives for treating viruses GENELABS, INC. 2006-09-21 US claimed
WO-2006076529-A1 INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2006-07-20 WO claimed
CN-113966325-A Fluorine-containing substituted imidazole salt compound, preparation method thereof, medicinal composition and application thereof 厦门华绰生物医药科技有限公司 2022-01-21 CN disclosed
CN-110612288-A Substituted imidazole salt compound, preparation method thereof, medicinal composition and application thereof 厦门华绰生物医药科技有限公司 2019-12-24 CN disclosed
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC. (JP) 2012-03-22 US disclosed
US-20120020920-A1 5-5-MEMBERED FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR JAPAN TOBACCO INC. (JP) 2012-01-26 US disclosed
EP-0783500-B1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LTD (GB) 1998-07-22 EP disclosed
WO-1997029104-A1 AMINOHETEROCYCLIC COMPOUNDS WITH ANTITHROMBOTIC/ANTICOAGULANT EFFECT ZENECA LIMITED (GB) 1997-08-14 WO disclosed
WO-1997028129-A1 AMINOHETEROCYCLIC DERIVATIVES AS ANTITHROMBOTIC OR ANTICOAGULANT AGENTS ZENECA LIMITED (GB) 1997-08-07 WO disclosed
EP-0162217-A1 1,2,4-Triazacycloalcadiene derivatives CIBA-GEIGY AG (CH) 1985-11-27 EP disclosed
EP-0157259-A1 3-Mercapto-1,2,4-triazacycloalcadiene derivatives CIBA-GEIGY AG (CH) 1985-10-09 EP 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 (3 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-20120020920-A1 5-5-MEMBERED FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR GTF3C5, ZC3HAV1, POLI HSD11B1 1282/4885KDM4E 1520/4885ALDH1A1 596/4885
US-20120070409-A1 TETRACYCLIC FUSED HETEROCYCLIC COMPOUND AND USE THEREOF AS HCV POLYMERASE INHIBITOR POLI, TERT, ZC3HAV1 HSD11B1 1382/4885KDM4E 2725/4885ALDH1A1 750/4885
US-20060211698-A1 Bicyclic heteroaryl derivatives for treating viruses HAVCR2, ZC3HAV1, SARS1 HSD11B1 542/4885KDM4E 2663/4885ALDH1A1 1627/4885

“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.