SCHEMBL5280416

SCHEMBL5280416

CC(C)(C)[Si](C)(C)Oc1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 9/20 0.57
PPARA Q07869 1/20 0.49
ALDH1A1 P00352 1/20 0.47
STS P08842 1/20 0.46
GAA P10253 1/20 0.46
SRD5A2 P31213 2/20 0.46
PREP P48147 1/20 0.46
PPARG P37231 1/20 0.46

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
SCHEMBL2500559 0.93 ELANE (0.52) ELANEPPARAPREPPPARG
SCHEMBL20364920 0.87 LMNA (0.53) ELANEALDH1A1SRD5A2PREP
SCHEMBL30829209 0.86 PREP (0.41) ELANEPREP
SCHEMBL30785086 0.86 STS (0.50) ELANEALDH1A1STSSRD5A2
SCHEMBL9700925 0.85 PREP (0.41) ELANEPPARAPREP
SCHEMBL6542930 0.84 CA1 (0.52) ALDH1A1SRD5A2PREP
SCHEMBL6524959 0.83 MEN1 (0.43) ELANEPREP
SCHEMBL7012599 0.83 PREP (0.43) ELANEALDH1A1SRD5A2PREPPPARG
SCHEMBL9339629 0.82 ELANE (0.61) ELANEALDH1A1STSGAASRD5A2
SCHEMBL3550962 0.81 MEN1 (0.49) ELANEALDH1A1STSGAAPREP

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
EP-1313560-B1 CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION UNIV YALE (US) 2007-12-19 EP disclosed
EP-1313560-A4 CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION UNIV YALE (US) 2005-02-09 EP disclosed
EP-1313560-A1 CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION YALE UNIVERSITY (US) 2003-05-28 EP disclosed
US-6562989-B2 Bicyclopentyl iron ligand and transition metal catalyst YALE UNIVERSITY 2003-05-13 US disclosed
US-20030008768-A1 Catalyst for aromatic C-O, C-N, and C-C bond formation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-01-09 US disclosed
WO-2002011883-A1 CATALYST FOR AROMATIC C-O, C-N, and C-C BOND FORMATION YALE UNIVERSITY (US) 2002-02-14 WO disclosed
US-5264491-A Block copolymers of styrene-isoprene and aromatic polyesters EDISON POLYMER INNOVATION CORPORATION (US) 1993-11-23 US disclosed
US-5081191-A Functionalized polymers prepared by anionic polymerization THE DOW CHEMICAL COMPANY (US) 1992-01-14 US disclosed
US-4975491-A Functionalized polymers prepared by anionic polymerization THE DOW CHEMICAL COMPANY (US) 1990-12-04 US disclosed