SCHEMBL10011166

SCHEMBL10011166

CCCCCCCCOC(=O)C(CC(C)(C)C)=C(CC(C)(C)C)C(=O)OCCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.55
NAAA Q02083 1/20 0.50
RAD52 P43351 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
EPHX1 P07099 1/20 0.47
HCAR2 Q8TDS4 1/20 0.43
FAAH O00519 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
ACHE P22303 6/20 0.42
DGKA P23743 1/20 0.41
HTR2C P28335 1/20 0.41

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
SCHEMBL10011159 1.00 TSHR (0.55) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL10011576 0.95 TSHR (0.50) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL10011572 0.95 TSHR (0.50) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL10010065 0.93 TSHR (0.49) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL10011375 0.93 TSHR (0.49) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL10010208 0.93 TSHR (0.49) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL10010202 0.93 TSHR (0.49) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL10011383 0.93 TSHR (0.49) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL10009326 0.93 TSHR (0.49) TSHRNAAARAD52NPSR1EPHX1
SCHEMBL10010059 0.93 TSHR (0.49) TSHRNAAARAD52NPSR1EPHX1

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
US-20120172551-A1 SOLID CATALYST FOR PROPYLENE POLYMERIZATION AND A METHOD FOR PREPARATION OF POLYPROPYLENE USING THE SAME SAMSUNG TOTAL PETROCHEMICALS CO., LTD. (KR) 2012-07-05 US disclosed