SCHEMBL12889705

SCHEMBL12889705

C=CCC(O)C1CCC(C)CC1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 2/20 0.36
TP53 P04637 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
SCHEMBL15769664 0.89
SCHEMBL13839652 0.78 TP53 (0.52) UGT2B7TP53
SCHEMBL420093 0.78 TP53 (0.52) UGT2B7TP53
SCHEMBL15184686 0.78 TP53 (0.52) UGT2B7TP53
SCHEMBL10596591 0.78 TP53 (0.52) UGT2B7TP53
SCHEMBL19276893 0.75 UGT2B7 (0.33) UGT2B7TP53
SCHEMBL19276892 0.75 UGT2B7 (0.33) UGT2B7TP53
SCHEMBL7738121 0.73 SHBG (0.39) TP53
SCHEMBL9999266 0.72 CYP3A4 (0.32) UGT2B7
SCHEMBL19277666 0.72 UGT2B7 (0.37) UGT2B7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8236917-B2 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2012-08-07 US disclosed
US-7888519-B2 Liquid crystals; using metastasis catalysts; reduction, hydrogenation MERCK PATENT GESELLSCHAFT (DE) 2011-02-15 US disclosed
US-20100240855-A1 Compound having silsesquioxane skeleton and its polymer JNC CORPORATION (JP) 2010-09-23 US disclosed
US-7314943-B2 Pyran derivatives containing an exocyclic double bond MERCK PATENT GMBH (DE) 2008-01-01 US disclosed