SCHEMBL15535508

SCHEMBL15535508

CC(=CCCOCCC=C(C)C(=O)O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CD81 P60033 2/20 0.39
PPARG P37231 1/20 0.34
BACE1 P56817 1/20 0.33
PTGS1 P23219 1/20 0.31
AKR1C3 P42330 1/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
TBXAS1 P24557 1/20 0.31
KDM4E B2RXH2 1/20 0.30
ATM Q13315 1/20 0.30
EP300 Q09472 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
SCHEMBL6851328 0.98 CD81 (0.38) CD81PPARGBACE1PTGS1AKR1C3
SCHEMBL6851323 0.98 CD81 (0.38) CD81PPARGBACE1PTGS1AKR1C3
SCHEMBL1874983 0.92 TSHR (0.40) CD81PPARGBACE1
SCHEMBL303833 0.92 CD81 (0.35) CD81PPARGBACE1EP300
SCHEMBL6681757 0.92 TSHR (0.40) CD81PPARGBACE1
SCHEMBL30729595 0.91 CD81 (0.37) CD81PPARGBACE1
SCHEMBL3167528 0.90 CD81 (0.34) CD81PPARG
SCHEMBL4577548 0.90 ALDH1A1 (0.45) CD81PPARG
SCHEMBL21082716 0.90 CD81 (0.34) CD81PPARG
SCHEMBL10923710 0.90 CD81 (0.34) CD81PPARG

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
EP-2856258-B1 PROCESS OF PRODUCTION OF A NANOPATTERNED ARTICLE USING NANOIMPRINT LITHOGRAPHY, NANOPATTERNED ARTICLE AND USES THEREOF MICRO RESIST TECH GESELLSCHAFT FUER CHEMISCHE MATERIALIEN SPEZIELLER PHOTORESISTSYSTEME MBH (DE) 2021-01-06 EP disclosed
EP-2856258-A1 COMPOSITION SUITABLE FOR USE AS A RELEASE-OPTIMIZED MATERIAL FOR NANOIMPRINT PROCESSES AND USES THEREOF Micro Resist Technology Gesellschaft für chemische Materialien spezieller Photoresistsysteme mbH (DE) 2015-04-08 EP disclosed
WO-2013174522-A1 COMPOSITION SUITABLE FOR USE AS A RELEASE-OPTIMIZED MATERIAL FOR NANOIMPRINT PROCESSES AND USES THEREOF MICRO RESIST TECHNOLOGY GESELLSCHAFT FÜR CHEMISCHE MATERIALIEN SPEZIELLER PHOTORESISTSYSTEME MBH (DE) 2013-11-28 WO disclosed