SCHEMBL10011079

SCHEMBL10011079

CCCCCCCCCC/C(C(=O)OCCCCCCCC)=C(\CC)C(=O)OCCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.55
TSHR P16473 3/20 0.55
DGKA P23743 1/20 0.50
RAD52 P43351 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
EPHX1 P07099 1/20 0.47
HTR2C P28335 1/20 0.45
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
CES2 O00748 3/20 0.43
CES1 P23141 3/20 0.43
HCAR2 Q8TDS4 1/20 0.43
THRB P10828 1/20 0.43
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
PGGT1B P53609 1/20 0.43
FAAH O00519 1/20 0.42
DNM1 Q05193 1/20 0.42

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
SCHEMBL10009323 1.00 NAAA (0.55) NAAATSHRDGKARAD52NPSR1
SCHEMBL10010006 1.00 NAAA (0.55) NAAATSHRDGKARAD52NPSR1
SCHEMBL10011084 1.00 NAAA (0.55) NAAATSHRDGKARAD52NPSR1
SCHEMBL10010610 1.00 NAAA (0.55) NAAATSHRDGKARAD52NPSR1
SCHEMBL10010658 1.00 NAAA (0.55) NAAATSHRDGKARAD52NPSR1
SCHEMBL10010615 1.00 NAAA (0.55) NAAATSHRDGKARAD52NPSR1
SCHEMBL10010654 1.00 NAAA (0.55) NAAATSHRDGKARAD52NPSR1
SCHEMBL10010008 1.00 NAAA (0.55) NAAATSHRDGKARAD52NPSR1
SCHEMBL10009320 1.00 NAAA (0.55) NAAATSHRDGKARAD52NPSR1
SCHEMBL10010620 0.96 TSHR (0.50) NAAATSHRDGKARAD52NPSR1

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