SCHEMBL8694967

SCHEMBL8694967

CCCCCC(O[SiH](C)C)c1ccccc1C(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 3/20 0.32
CTSG P08311 2/20 0.32
CTRB1 P17538 2/20 0.32
CMA1 P23946 2/20 0.32
SLC37A4 O43826 1/20 0.31
PPARG P37231 2/20 0.31
PRSS2 P07478 1/20 0.30
PRSS3 P35030 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
SCHEMBL17328900 0.78 PRSS1 (0.35) PRSS1CTSGCTRB1CMA1SLC37A4
SCHEMBL4595231 0.78 PRSS1 (0.35) PRSS1CTSGCTRB1CMA1SLC37A4
SCHEMBL1788362 0.74 GAA (0.40) PRSS1CTSGCTRB1CMA1
SCHEMBL3149363 0.72 ALDH1A1 (0.36)
SCHEMBL29070986 0.71 ALDH1A1 (0.33) PRSS1CTSGCTRB1CMA1PPARG
SCHEMBL707595 0.71 TSHR (0.33)
SCHEMBL8924361 0.70 ALDH1A1 (0.39)
SCHEMBL6055204 0.70 ALDH1A1 (0.39) PRSS1CTSGCTRB1CMA1PPARG
SCHEMBL8925206 0.70 ALDH1A1 (0.35)
SCHEMBL29268649 0.69 CA2 (0.41) PRSS1CTSGCTRB1CMA1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998011078-A1 MATERIALS FOR OPTICAL STORAGE DEVICES CHISSO CORPORATION (JP) 1998-03-19 WO disclosed