SCHEMBL5029804

SCHEMBL5029804

Cc1cc(C)c([Si](OCC(C)C)(OCC(C)C)OCC(C)C)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 5/20 0.37
NOS3 P29474 3/20 0.37
NOS1 P29475 3/20 0.37
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL5031063 0.80 SCN4A (0.40) ALDH1A1
SCHEMBL2478476 0.77 NOS3 (0.33) NOS2NOS3NOS1KDM4EALDH1A1
SCHEMBL5554342 0.73 NOS2 (0.33) NOS2NOS3NOS1KDM4EALDH1A1
SCHEMBL5032243 0.72 FFAR4 (0.34) KDM4EALDH1A1
SCHEMBL5029870 0.71 NOS2 (0.37) NOS2NOS3NOS1KDM4E
SCHEMBL5029792 0.71 SCN4A (0.37) KDM4EALDH1A1
SCHEMBL5140507 0.69 TSHR (0.35) NOS2NOS1KDM4EALDH1A1
SCHEMBL3108980 0.69 ACHE (0.39) NOS2NOS3NOS1KDM4EALDH1A1
SCHEMBL18092256 0.65 PTPN1 (0.36) NOS2NOS3NOS1
SCHEMBL12767969 0.65 ALDH1A1 (0.47) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1999167-A2 ZIEGLER-NATTA CATALYST WITH IN SITU-GENERATED DONOR Novolen Technology Holdings, C.V. (NL) 2008-12-10 EP disclosed
WO-2007106348-A2 ZIEGLER-NATTA CATALYST WITH IN SITU-GENERATED DONOR NOVOLEN TECHNOLOGY HOLDINGS C.V. (NL) 2007-09-20 WO disclosed
US-20070213204-A1 Ziegler-Natta catalyst with in situ-generated donor NOVOLEN TECHNOLOGY HOLDINGS C.V. 2007-09-13 US disclosed