SCHEMBL5337599

SCHEMBL5337599

CCOC(=O)c1csc(-c2ccccc2OC)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.56
NPC1 O15118 6/20 0.56
MAPT P10636 5/20 0.56
NPSR1 Q6W5P4 2/20 0.56
POLB P06746 1/20 0.56
PKM P14618 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
ALDH1A1 P00352 2/20 0.54
SMN1; SMN2 Q16637 3/20 0.53
HSD17B10 Q99714 2/20 0.53
HPGD P15428 2/20 0.53
KDM4E B2RXH2 1/20 0.53
GAA P10253 1/20 0.53
MAOA P21397 1/20 0.52
ACHE P22303 1/20 0.52
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
HSP90AA1 P07900 1/20 0.51
LMNA P02545 1/20 0.51
TSHR P16473 1/20 0.49

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
SCHEMBL30671738 1.00 RAB9A (0.56) RAB9ANPC1MAPTNPSR1POLB
SCHEMBL7167459 0.88 RAB9A (0.53) RAB9ANPC1MAPTNPSR1POLB
SCHEMBL24565527 0.86 ACHE (0.68) RAB9ANPC1ALDH1A1SMN1; SMN2HSD17B10
SCHEMBL15754817 0.85 RAB9A (0.60) RAB9ANPC1MAPTNPSR1POLB
SCHEMBL6984908 0.84 RAB9A (0.57) RAB9ANPC1MAPTNPSR1POLB
SCHEMBL6224829 0.84 RAB9A (0.61) RAB9ANPC1MAPTNPSR1POLB
SCHEMBL2551417 0.84 HTR2B (0.61) RAB9ANPC1MAPTNPSR1POLB
SCHEMBL27995632 0.83 ALDH1A1 (0.52) RAB9ANPC1ALDH1A1SMN1; SMN2HSD17B10
SCHEMBL5896297 0.83 RAB9A (0.61) RAB9ANPC1MAPTNPSR1POLB
SCHEMBL3436031 0.83 RAB9A (0.68) RAB9ANPC1MAPTNPSR1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117209488-A Alkaloid barakacin derivative, synthesis thereof and application thereof in prevention and treatment of plant virus and germ diseases 天津师范大学 2023-12-12 CN claimed
CN-117209488-A Alkaloid barakacin derivative, synthesis thereof and application thereof in prevention and treatment of plant virus and germ diseases 天津师范大学 2023-12-12 CN disclosed
US-7196104-B2 Thiazolyl urea compounds and methods of uses AMGEN, INC. (US) 2007-03-27 US disclosed
EP-1309589-B1 UREA COMPOUNDS AND METHODS OF USES AMGEN INC (US) 2006-03-15 EP disclosed
EP-1619184-A2 Urea compounds as kinase inhibitors Amgen, Inc. (US) 2006-01-25 EP disclosed
EP-1483263-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2004-12-08 EP disclosed
US-20040044044-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-03-04 US disclosed
US-20040039029-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2004-02-26 US disclosed
US-6645990-B2 For prophylaxis and therapy of diseases, such as cell proliferation or apoptosis mediated diseases AMGEN INC. 2003-11-11 US disclosed
WO-2003070727-A1 THIAZOLYL UREA COMPOUNDS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2003-08-28 WO disclosed
US-20020077455-A1 Protease inhibitors SMITHKLINE BEECHAM CORPORATION 2002-06-20 US disclosed
WO-2002014311-A2 UREA COMPOUNDS AND METHODS OF USES AMGEN INC. (US) 2002-02-21 WO disclosed
US-6331542-B1 TREATING DISEASES CHARACTERIZED BY BONE LOSS OR EXCESSIVE CARTILAGE OR MATRIX DEGRADATION SMITHKLINE BEECHAM CORPORATION 2001-12-18 US disclosed
US-6284777-B1 BONE DISORDERS SMITHKLINE BEECHAM CORPORATION 2001-09-04 US disclosed
US-6232342-B1 CATHEPSIN K INHIBITOR FOR TREATING OSTEOPOROSIS, GINGIVITIS, PERIODONTITIS, ARTHRITIS, OSTEOARTHRITIS RHEUMATOID ARTHRITIS, PAGET'S DISEASE, HYPERCALCEMIA OF MALIGNANCY AND METABOLIC BONE DISEASES SMITHKLINE BEECHAM CORPORATION 2001-05-15 US disclosed
US-6057362-A Protease inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2000-05-02 US disclosed
US-5998470-A Protease inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1999-12-07 US disclosed
EP-0934291-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1999-08-11 EP disclosed
EP-0934291-A4 SMITHKLINE BEECHAM CORP (US) 1999-08-11 EP disclosed
WO-1997016433-A1 PROTEASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 1997-05-09 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-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX RAB9A 3370/4885NPC1 548/4885MAPT 1437/4885
US-20020077455-A1 Protease inhibitors CTSK, CTSZ, CTSG RAB9A 1337/4885NPC1 862/4885MAPT 1072/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX RAB9A 3370/4885NPC1 548/4885MAPT 1437/4885

“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.