SCHEMBL1754049

SCHEMBL1754049

O=C(O)N1CSc2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.53
KDM4E B2RXH2 1/20 0.50
HSD17B3 P37058 1/20 0.49
SLC22A12 Q96S37 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
LMNA P02545 2/20 0.42
HPGD P15428 1/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
BCHE P06276 5/20 0.41
ACHE P22303 3/20 0.41
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
MITF O75030 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NOX1 Q9Y5S8 1/20 0.39
GSK3B P49841 1/20 0.39
MEN1 O00255 1/20 0.39
DRD4 P21917 1/20 0.38
TP53 P04637 1/20 0.38

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
Hydrochloric Acid SCHEMBL27756629 0.98 NOTUM (0.51) NOTUMKDM4EHSD17B3SLC22A12L3MBTL1
SCHEMBL5026715 0.83 NOTUM (0.51) NOTUMKDM4EHSD17B3SLC22A12L3MBTL1
SCHEMBL11354049 0.82 NOTUM (0.47) NOTUMKDM4EHSD17B3SLC22A12L3MBTL1
SCHEMBL15524285 0.81 NOTUM (0.73) NOTUMKDM4EL3MBTL1LMNAHPGD
Acetic Acid SCHEMBL5028762 0.81 NOTUM (0.54) NOTUMKDM4EHSD17B3SLC22A12L3MBTL1
SCHEMBL11193164 0.80 NOTUM (0.49) NOTUMKDM4EHSD17B3SLC22A12L3MBTL1
SCHEMBL4724326 0.79 NOTUM (0.51) NOTUMKDM4EHSD17B3SLC22A12L3MBTL1
SCHEMBL11407839 0.79 BCHE (0.54) NOTUMKDM4EHSD17B3SLC22A12L3MBTL1
SCHEMBL28542746 0.78 NOTUM (0.46) NOTUMKDM4EHSD17B3SLC22A12L3MBTL1
SCHEMBL28307229 0.77 BCHE (0.58) NOTUMKDM4EL3MBTL1SMN1; SMN2BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2655368-A1 COMPOSITIONS AND METHODS FOR MODULATING FARNESOID X RECEPTORS IRM LLC (BM) 2013-10-30 EP claimed
WO-2012087520-A1 COMPOSITIONS AND METHODS FOR MODULATING FARNESOID X RECEPTORS IRM LLC (BM) 2012-06-28 WO claimed
EP-1981883-A1 NOVEL HETEROARYL SUBSTITUTED BENZOTHIAZOLES AstraZeneca AB (SE) 2008-10-22 EP claimed
CN-101119980-A Novel benzothiazole carboxamides ASTRAZENECA AB (SE) 2008-02-06 CN claimed
WO-2007086800-A1 NOVEL HETEROARYL SUBSTITUTED BENZOTHIAZOLES ASTRAZENECA AB (SE) 2007-08-02 WO claimed
EP-4321504-B1 PEGYLATED LIPID AND LIPOSOME MODIFIED THEREBY, AND PHARMACEUTICAL COMPOSITION COMPRISING LIPOSOME AND PREPARATION AND USE THEREOF XIAMEN SINOPEG BIOTECH CO LTD (CN) 2026-02-18 EP disclosed
US-20240197633-A1 PEGYLATED LIPID, LIPOSOME MODIFIED BY THE LIPID, PHARMACEUTICAL COMPOSITION CONTAINING THE LIPOSOME, FORMULATION AND APPLICATION THEREOF XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2024-06-20 US disclosed
US-20240180951-A1 PEGYLATED LIPID, LIPOSOME MODIFIED BY THE LIPID, PHARMACEUTICAL COMPOSITION CONTAINING THE LIPOSOME, FORMULATION AND APPLICATION THEREOF XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2024-06-06 US disclosed
WO-2024041460-A1 NOVEL NLRP3 INFLAMMASOME INHIBITORS HANGZHOU HIGHLIGHTLL PHARMACEUTICAL CO., LTD (CN) 2024-02-29 WO disclosed
EP-4321504-A1 PEGYLATED LIPID AND LIPOSOME MODIFIED THEREBY, AND PHARMACEUTICAL COMPOSITION COMPRISING LIPOSOME AND PREPARATION AND USE THEREOF Xiamen Sinopeg Biotech Co., Ltd. (CN) 2024-02-14 EP disclosed
EP-4321503-A1 PEGYLATED LIPID, LIPOSOME MODIFIED THEREBY, PHARMACEUTICAL COMPOSITION CONTAINING LIPOSOME, PREPARATION THEREOF, AND USE THEREOF Xiamen Sinopeg Biotech Co., Ltd. (CN) 2024-02-14 EP disclosed
WO-2023186020-A1 NLRP3 INFLAMMASOME INHIBITORS HANGZHOU HIGHLIGHTLL PHARMACEUTICAL CO., LTD (CN) 2023-10-05 WO disclosed
EP-1677791-A2 NITROGEN-CONTAINING FUSED HETEROCYCLIC COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2006-07-12 EP disclosed
CN-1726033-A Treatment of diseases with combinations of alpha 7 nicotinic acetylcholine receptor agonists and other compounds PHARMACIA & UPJOHN CO LLC (US) 2006-01-25 CN disclosed
CN-1684962-A Indazoles, benzothiazoles, and benzisothiazoles, and preparation and use thereof MEMORY PHARM CORP (US) 2005-10-19 CN disclosed
WO-2005044793-A2 NITROGEN-CONTAINING FUSED HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-05-19 WO disclosed
EP-0938477-A4 BENZOTHIAZO AND RELATED HETEROCYCLIC GROUP-CONTAINING CYSTEINE AND SERINE PROTEASE INHIBITORS CEPHALON INC (US) 1999-12-29 EP disclosed
US-5952328-A MAY BE USED TO ALLEVIATE, MEDIATE, REDUCE AND/OR PREVENT DISORDERS WHICH ARE ASSOCIATED WITH ABNORMAL AND/OR ABERRANT ACTIVITY OF CYSTEINE PROTEASES AND/OR SERINE PROTEASES CEPHALON, INC. (US) 1999-09-14 US disclosed
EP-0938477-A1 BENZOTHIAZO AND RELATED HETEROCYCLIC GROUP-CONTAINING CYSTEINE AND SERINE PROTEASE INHIBITORS CEPHALON, INC. (US) 1999-09-01 EP disclosed
WO-1998021186-A1 BENZOTHIAZO AND RELATED HETEROCYCLIC GROUP-CONTAINING CYSTEINE AND SERINE PROTEASE INHIBITORS CEPHALON, INC. (US) 1998-05-22 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 (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-20240180951-A1 PEGYLATED LIPID, LIPOSOME MODIFIED BY THE LIPID, PHARMACEUTICAL COMPOSITION CONTAINING THE LIPOSOME, FORMULATION AND APPLICATION THEREOF LIPG, PHOSPHO1, LDLR NOTUM 4372/4885KDM4E 2140/4885HSD17B3 4130/4885
US-20240197633-A1 PEGYLATED LIPID, LIPOSOME MODIFIED BY THE LIPID, PHARMACEUTICAL COMPOSITION CONTAINING THE LIPOSOME, FORMULATION AND APPLICATION THEREOF LIPG, LDLR, LIPA NOTUM 3408/4885KDM4E 1858/4885HSD17B3 4488/4885

“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.