SCHEMBL9312401

SCHEMBL9312401

CC=C(CCCCCC)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.56
CES1 P23141 3/20 0.56
TDP1 Q9NUW8 2/20 0.47
PTGS2 P35354 2/20 0.47
NAAA Q02083 1/20 0.46
TBXAS1 P24557 1/20 0.46
LMNA P02545 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 1/20 0.44
EPHX2 P34913 1/20 0.44

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
SCHEMBL11896276 1.00 CES2 (0.56) CES2CES1TDP1PTGS2NAAA
SCHEMBL27608811 1.00 CES2 (0.56) CES2CES1TDP1PTGS2NAAA
SCHEMBL27526812 1.00 CES2 (0.56) CES2CES1TDP1PTGS2NAAA
SCHEMBL11147118 0.98 CES2 (0.55) CES2CES1TDP1PTGS2NAAA
SCHEMBL7944718 0.92 PTGS2 (0.55) CES2CES1PTGS2NAAALMNA
SCHEMBL11352148 0.84 TDP1 (0.59) CES2CES1TDP1PTGS2NAAA
SCHEMBL7803887 0.84 CES2 (0.50) CES2CES1PTGS2LMNAL3MBTL1
SCHEMBL7803886 0.84 CES2 (0.50) CES2CES1PTGS2LMNAL3MBTL1
SCHEMBL4236339 0.83 CES2 (0.51) CES2CES1TDP1PTGS2NAAA
SCHEMBL10964304 0.82 CES2 (0.54) CES2CES1TDP1PTGS2NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4068676-A RELEASE AGENTS HALLIBURTON COMPANY (US) 1978-01-17 US claimed
US-5326489-A Sulfonated polymer NIPPON SHOKUBAI CO., LTD. (JP) 1994-07-05 US disclosed
EP-0523300-B1 Electrorheological fluids NIPPON CATALYTIC CHEM IND (JP) 1994-01-19 EP disclosed
EP-0523300-A1 Electrorheological fluids NIPPON SHOKUBAI KAGAKU KOGYO CO. LTD. (JP) 1993-01-20 EP disclosed
US-4620048-A POLYMER HAVE NARROW MOLECULAR WEIGHT DISTRIBUTION EXXON RESEARCH & ENGINEERING CO. (US) 1986-10-28 US disclosed
US-4068676-A RELEASE AGENTS HALLIBURTON COMPANY (US) 1978-01-17 US disclosed