SCHEMBL4743391

SCHEMBL4743391

CC(CC(=O)O)C1CC2C=CC1C2

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.37
LMNA P02545 1/20 0.37
EPHX2 P34913 4/20 0.35
ALDH1A1 P00352 4/20 0.34
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL11604002 0.87 KDM4E (0.38) KDM4ELMNAEPHX2ALDH1A1TDP1
SCHEMBL11614512 0.86 POLB (0.34) ALDH1A1TDP1
SCHEMBL2070938 0.82 KDM4E (0.41) KDM4ELMNAEPHX2ALDH1A1TDP1
SCHEMBL3293689 0.78 KDM4E (0.39) KDM4ELMNAEPHX2ALDH1A1TDP1
SCHEMBL31031260 0.77
SCHEMBL16949842 0.77 KDM4E (0.37) KDM4EALDH1A1
SCHEMBL10939675 0.77 EPHX2 (0.35) KDM4ELMNAEPHX2TDP1
SCHEMBL1143057 0.76 EPHX2 (0.37) KDM4ELMNAEPHX2ALDH1A1TDP1
SCHEMBL1446189 0.75 KDM4E (0.37) KDM4ELMNAEPHX2ALDH1A1
SCHEMBL4740071 0.75 GPR84 (0.43) KDM4EEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080199805-A1 PHOTOSENSITIVE COMPOSITIONS EMPLOYING SILICON-CONTAINING ADDITIVES FUJIFILM ELECTRONIC MATERIALS. U.S.A., INC. 2008-08-21 US disclosed
WO-2008098189-A1 PHOTOSENSITIVE COMPOSITIONS EMPLOYING SILICON-CONTAINING ADDITIVES FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2008-08-14 WO disclosed
US-4091020-A CONDENSATION, CATALYTIC DECARBOXYLATION MERCK & CO., INC. (US) 1978-05-23 US disclosed
US-4003934-A ANTIMICROBIAL AGENTS, ALGAE INHIBITORS MERCK & CO., INC. (US) 1977-01-18 US disclosed