SCHEMBL6643211

SCHEMBL6643211

CCOC(=O)c1ccsc1NC=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.53
KMT2A Q03164 5/20 0.53
MEN1 O00255 4/20 0.53
USP2 O75604 1/20 0.53
TSHR P16473 3/20 0.50
LMNA P02545 3/20 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
NR2F2 P24468 1/20 0.44
NTSR1 P30989 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
HPGD P15428 2/20 0.41
NPC1 O15118 2/20 0.41
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
GAA P10253 2/20 0.41

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
SCHEMBL1992502 0.82 CYP3A4 (0.51) ALDH1A1KMT2AMEN1USP2TSHR
SCHEMBL11638233 0.80 PTK2 (0.59) ALDH1A1KMT2AMEN1TSHRLMNA
SCHEMBL7842718 0.79 TSHR (0.46) ALDH1A1KMT2AMEN1USP2TSHR
SCHEMBL15440489 0.79 HPGD (0.53) ALDH1A1KMT2AMEN1TSHRNR2F2
SCHEMBL6636910 0.79 TSHR (0.46) ALDH1A1KMT2AMEN1USP2TSHR
SCHEMBL31469754 0.78 MEN1 (0.50) ALDH1A1KMT2AMEN1USP2NR2F2
SCHEMBL9396580 0.78 MEN1 (0.48) ALDH1A1KMT2AMEN1USP2TSHR
SCHEMBL9398335 0.77 PKM (0.47) ALDH1A1KMT2AMEN1USP2TSHR
SCHEMBL8628177 0.76 TSHR (0.50) ALDH1A1KMT2AMEN1USP2TSHR
SCHEMBL1977053 0.76 ALDH1A1 (0.54) ALDH1A1KMT2AMEN1TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015114663-A1 NOVEL THIENO [2,3-D]PYRIMIDIN-4(3H)-ONE COMPOUNDS WITH ANTIMYCOBACTERIAL PROPERTIES COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2015-08-06 WO disclosed
EP-1018514-B1 NF-$g(k)B INHIBITORS CONTAINING INDAN DERIVATIVES AS THE ACTIVE INGREDIENT DAIICHI SUNTORY PHARMA CO LTD (JP) 2004-05-12 EP disclosed
US-6734180-B1 NF-κB inhibitor comprising an indan derivative as an active ingredient DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2004-05-11 US disclosed
US-6703421-B1 ADMINISTERING NF-KAPPA B INHIBITOR DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2004-03-09 US disclosed
US-6541630-B1 7-bromo-3-methyl-3,4- dihydrothieno(3,2-d)pyrimidin-4-one AGREVO UK LIMITED (GB) 2003-04-01 US disclosed
EP-0982992-B1 Use of thienopyrimidines as fungicides AVENTIS CROPSCIENCE UK LTD (GB) 2002-09-25 EP disclosed
US-6432964-B1 A THIENYLPYRIMIDINE COMPOUND AGREVO UK LIMITED (GB) 2002-08-13 US disclosed
EP-1132093-A1 PREVENTIVES OR REMEDIES FOR MYOCARDITIS, DILATED CARDIOMYOPATHY AND CARDIAC INSUFFICIENCY CONTAINING NF-KAPPA B INHIBITORS AS THE ACTIVE INGREDIENT SUNTORY LIMITED (JP) 2001-09-12 EP disclosed
EP-1018514-A1 NF-$g(k)B INHIBITORS CONTAINING INDAN DERIVATIVES AS THE ACTIVE INGREDIENT SUNTORY LIMITED (JP) 2000-07-12 EP disclosed
EP-0982992-A1 FUNGICIDES AgrEvo UK Limited (GB) 2000-03-08 EP disclosed
WO-1998049899-A1 FUNGICIDES AGREVO UK LIMITED (GB) 1998-11-12 WO disclosed
EP-0452002-A2 Thienopyrimidine derivatives DOWELANCO (US) 1991-10-16 EP disclosed
US-4108867-A 2-Aminothiophenes IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1978-08-22 US disclosed