SCHEMBL5618655

SCHEMBL5618655

NCCCS(=O)(=O)N1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
APP P05067 1/20 0.41
TSHR P16473 3/20 0.39
ALDH1A1 P00352 3/20 0.39
GMNN O75496 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
MAPK1 P28482 1/20 0.39
THPO P40225 1/20 0.39
HBB P68871 1/20 0.39
PMP22 Q01453 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SMYD3 Q9H7B4 5/20 0.37
HPGD P15428 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL1389327 0.91 CA1 (0.39) CA1CA2APPTSHRLMNA
SCHEMBL1389439 0.90 CA1 (0.43) CA1CA2APPTSHRALDH1A1
SCHEMBL1389573 0.90 CA1 (0.43) CA1CA2APPTSHRALDH1A1
SCHEMBL5022227 0.86 CA1 (0.46) CA1CA2TSHRALDH1A1LMNA
SCHEMBL22482174 0.84 CA1 (0.50) CA1CA2TSHRALDH1A1LMNA
SCHEMBL22482247 0.81 CA1 (0.40) CA1CA2TSHRALDH1A1LMNA
SCHEMBL22123202 0.81 KDM4E (0.41) APPTSHRALDH1A1GMNNLMNA
SCHEMBL31061327 0.81 L3MBTL1 (0.41) APPTSHRALDH1A1GMNNLMNA
SCHEMBL4274142 0.81 LMNA (0.49) APPTSHRALDH1A1GMNNLMNA
SCHEMBL16235813 0.77 EPHX2 (0.38) CA1CA2TSHRALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11591301-B2 Indoleamine-2,3-dioxygenase inhibitor, preparation method therefor and use thereof HINOVA PHARMACEUTICALS INC. (CN) 2023-02-28 US disclosed
US-20210047281-A1 INDOLEAMINE-2,3-DIOXYGENASE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF HINOVA PHARMACEUTICALS INC. (CN) 2021-02-18 US disclosed
WO-2019149255-A1 INDOLEAMINE-2,3-DIOXYGENASE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 成都海创药业有限公司 2019-08-08 WO disclosed
US-7157457-B2 Compounds useful in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2007-01-02 US disclosed
EP-1324991-B1 COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LTD (GB) 2006-11-15 EP disclosed
EP-1586567-A1 Compounds useful in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2005-10-19 EP disclosed
US-20040058907-A1 Compounds useful in the treatment of inflammatory diseases GLAXO GROUP LIMITED (GB) 2004-03-25 US disclosed
EP-1324991-A1 COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LIMITED (GB) 2003-07-09 EP disclosed
WO-2002026723-A1 COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATORY DISEASES GLAXO GROUP LIMITED (GB) 2002-04-04 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 (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-11591301-B2 Indoleamine-2,3-dioxygenase inhibitor, preparation method therefor and use thereof IDO1, IDO2, TPH1 CA1 2105/4885CA2 2699/4885APP 689/4885
US-20210047281-A1 INDOLEAMINE-2,3-DIOXYGENASE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF IDO1, IDO2, TPH1 CA1 2105/4885CA2 2699/4885APP 689/4885
US-20040058907-A1 Compounds useful in the treatment of inflammatory diseases TNF, IL1B, IL4 CA1 4593/4885CA2 4182/4885APP 1775/4885

“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.