SCHEMBL4259628

SCHEMBL4259628

CCP(=O)(CC)OCOP(=O)(CC)CC

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
TP53 P04637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP3A4 P08684 2/20 0.33
PPARD Q03181 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL564170 0.80
SCHEMBL5488959 0.80 TSHR (0.43) TSHRTP53TDP1CYP3A4PPARD
SCHEMBL28639056 0.78 TSHR (0.55) TSHRTP53TDP1PPARD
SCHEMBL28829611 0.78 TSHR (0.55) TSHRTP53TDP1PPARD
SCHEMBL5485248 0.75 CYP3A4 (0.48) TSHRCYP3A4
SCHEMBL5491463 0.75 CYP3A4 (0.48) TSHRTP53TDP1CYP3A4
SCHEMBL575364 0.75 CYP3A4 (0.42) TSHRTP53TDP1CYP3A4PPARD
SCHEMBL3803539 0.75
SCHEMBL2487795 0.75
SCHEMBL27401476 0.75

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
US-8829104-B2 Styrene-based resin composition, and resin molded article comprising same ASAHI KASEI CHEMICALS CORPORATION (JP) 2014-09-09 US disclosed
US-20130012646-A1 STYRENE-BASED RESIN COMPOSITION, AND RESIN MOLDED ARTICLE COMPRISING SAME ASAHI KASEI CHEMICALS CORPORATION (JP) 2013-01-10 US disclosed
WO-2009118712-A2 NOVEL DIHYDROXYPYRROLIDINE DERIVATIVES AS ANTI-CANCER AGENTS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2009-10-01 WO disclosed