SCHEMBL5345430

SCHEMBL5345430

COc1ccc(OCc2nc(C(=O)O)cs2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.72
NPC1 O15118 5/20 0.72
RAB9A P51151 5/20 0.72
HSP90AA1 P07900 1/20 0.72
MMP13 P45452 5/20 0.51
MMP2 P08253 4/20 0.51
POLB P06746 4/20 0.50
LMNA P02545 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 2/20 0.50
GAA P10253 2/20 0.50
ALOX12 P18054 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
PPARD Q03181 1/20 0.50
PPARA Q07869 1/20 0.50
MMP1 P03956 2/20 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
SCHEMBL3558198 0.96 MAPT (0.67) MAPTNPC1RAB9AHSP90AA1MMP13
SCHEMBL3348750 0.87 MAPT (0.58) MAPTNPC1RAB9AHSP90AA1MMP13
SCHEMBL11703618 0.86 MAPT (0.78) MAPTNPC1RAB9AHSP90AA1MMP13
SCHEMBL3555592 0.85 MAPT (0.57) MAPTNPC1RAB9AHSP90AA1MMP13
SCHEMBL3568125 0.84 MAPT (0.56) MAPTNPC1RAB9AHSP90AA1MMP13
SCHEMBL7071567 0.84 MAPT (1.00) MAPTNPC1RAB9AHSP90AA1MMP13
SCHEMBL1979349 0.83 LMNA (0.70) MAPTNPC1RAB9AHSP90AA1MMP13
SCHEMBL3556746 0.82 MAPT (0.72) MAPTNPC1RAB9AHSP90AA1MMP13
SCHEMBL14302573 0.82 MAPT (0.54) MAPTNPC1RAB9AHSP90AA1MMP13
SCHEMBL3560701 0.82 MAPT (0.54) MAPTNPC1RAB9AHSP90AA1MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-1309589-A2 UREA COMPOUNDS AND METHODS OF USES Amgen Inc. (US) 2003-05-14 EP disclosed
US-20020193405-A1 Thiazolyl urea compounds and methods of uses AMGEN INC. 2002-12-19 US disclosed
US-20020173507-A1 Urea compounds and methods of uses AMGEN INC. 2002-11-21 US disclosed
WO-2002014311-A2 UREA COMPOUNDS AND METHODS OF USES AMGEN INC. (US) 2002-02-21 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 (4 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-20020193405-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX MAPT 1437/4885NPC1 548/4885RAB9A 3370/4885
US-20020173507-A1 Urea compounds and methods of uses SLC14A1, UMPS, BAX MAPT 1801/4885NPC1 621/4885RAB9A 2958/4885
US-20040039029-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX MAPT 1437/4885NPC1 548/4885RAB9A 3370/4885
US-20040044044-A1 Thiazolyl urea compounds and methods of uses SLC14A1, UMPS, BAX MAPT 1437/4885NPC1 548/4885RAB9A 3370/4885

“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.