SCHEMBL89254

SCHEMBL89254

S=C1NC(=S)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.48
GSK3B P49841 1/20 0.43
KDM4E B2RXH2 4/20 0.40
RXFP1 Q9HBX9 1/20 0.39
ALOX12 P18054 3/20 0.38
LMNA P02545 2/20 0.38
KMT2A Q03164 5/20 0.36
MAPT P10636 3/20 0.36
CYP3A4 P08684 1/20 0.36
PSMB8 P28062 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CASP3 P42574 1/20 0.36
CASP2 P42575 1/20 0.36
CASP7 P55210 1/20 0.36
CASP6 P55212 1/20 0.36
CASP8 Q14790 1/20 0.36
MEN1 O00255 3/20 0.35
CDC25B P30305 1/20 0.35
MAOA P21397 2/20 0.35

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
SCHEMBL5319377 0.85 ALDH1A1 (0.43) ALDH1A1GSK3BKDM4ERXFP1ALOX12
SCHEMBL182539 0.81 GSK3B (0.67) ALDH1A1GSK3BKDM4EALOX12LMNA
SCHEMBL2643929 0.79
SCHEMBL12683716 0.79 ALDH1A1 (0.59) ALDH1A1GSK3BKDM4ERXFP1LMNA
SCHEMBL31436379 0.79 GSK3B (0.64) ALDH1A1GSK3BKDM4EALOX12LMNA
SCHEMBL2511248 0.75 ALDH1A1 (0.55) ALDH1A1GSK3BKDM4ERXFP1ALOX12
Formic Acid SCHEMBL19514734 0.72 GSK3B (0.54) ALDH1A1GSK3BKDM4EALOX12LMNA
SCHEMBL9204546 0.70 ALDH1A1 (0.37) ALDH1A1GSK3BKDM4ERXFP1ALOX12
SCHEMBL3077372 0.69 ALDH1A1 (0.50) ALDH1A1GSK3BKDM4ERXFP1LMNA
SCHEMBL2583571 0.67 CYP2A6 (0.43) ALDH1A1KDM4EALOX12LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115724786-A Amide alkane dithiophthalimide compound, preparation method and application thereof 四川大学 2023-03-03 CN claimed
JP-2007505922-A 2007-03-15 JP claimed
CN-1867331-A Thalidomide analogs as TNF-alpha modulators US GOV HEALTH & HUMAN SERV (US) 2006-11-22 CN claimed
US-20060211728-A1 Thalidomide analogs P2D INC. 2006-09-21 US claimed
EP-1663223-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, represented by THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2006-06-07 EP claimed
WO-2005028436-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-03-31 WO claimed
CN-119638696-A Methods and compositions for modulating splicing 斯基霍克疗法公司 2025-03-18 CN disclosed
CN-119320388-A Methods and compositions for modulating splicing 斯基霍克疗法公司 2025-01-17 CN disclosed
CN-118812532-A Methods and compositions for modulating splicing 斯基霍克疗法公司 2024-10-22 CN disclosed
CN-115335369-B GEM-disubstituted piperidine melanocortin subtype-2 receptor (MC 2R) antagonists and uses thereof 克林提克斯医药股份有限公司 2024-07-02 CN disclosed
CN-117916368-A Base editing of thyroxine transporter genes 比姆医疗股份有限公司 2024-04-19 CN disclosed
CN-110637015-B Fanisole X receptor agonist and application thereof 奥加诺沃公司 2024-04-02 CN disclosed
CN-111194215-B Methods and compositions for modulating splicing 斯基霍克疗法公司 2024-03-01 CN disclosed
US-20080194629-A1 3-Mono-and 3,5-Disubstituted Piperidine Derivatives as Renin Inhibitors BAESCHLIN DANIEL KASPAR 2008-08-14 US disclosed
CN-1867331-A Thalidomide analogs as TNF-alpha modulators US GOV HEALTH & HUMAN SERV (US) 2006-11-22 CN disclosed
WO-2006100036-A1 3, 4-SUBSTITUTED PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF HYPERTENSION NOVARTIS AG (CH) 2006-09-28 WO disclosed
US-20060211728-A1 Thalidomide analogs P2D INC. 2006-09-21 US disclosed
EP-1663223-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, represented by THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2006-06-07 EP disclosed
WO-2005028436-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-03-31 WO disclosed
EP-0211805-A2 N-(2-fluorophenyl)azolidines CIBA-GEIGY AG (CH) 1987-02-25 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 (2 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-20060211728-A1 Thalidomide analogs TNF, TNFRSF1A, PGF ALDH1A1 336/4885GSK3B 3325/4885KDM4E 3440/4885
US-20080194629-A1 3-Mono-and 3,5-Disubstituted Piperidine Derivatives as Renin Inhibitors REN, ACE, AGTR1 ALDH1A1 231/4885GSK3B 4207/4885KDM4E 950/4885

“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.