SCHEMBL9836703

SCHEMBL9836703

CCCCC/C=C(\C)C(O)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.42
EP300 Q09472 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
FAAH O00519 3/20 0.38
TP53 P04637 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAPT P10636 1/20 0.37
CYP2C9 P11712 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 1/20 0.37
ABCB1 P08183 1/20 0.37
DGKA P23743 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL9836706 1.00 ZDHHC7 (0.42) ZDHHC7EP300CA1CA2FAAH
SCHEMBL9835712 0.87 CA1 (0.36) ZDHHC7CA1CA2CYP1A2CYP2D6
SCHEMBL9835716 0.87 CA1 (0.36) ZDHHC7CA1CA2CYP1A2CYP2D6
SCHEMBL9837586 0.77 MAPT (0.42) ZDHHC7CA1CA2FAAHTP53
SCHEMBL9837589 0.77 MAPT (0.42) ZDHHC7CA1CA2FAAHTP53
SCHEMBL9691660 0.74 ALDH1A1 (0.39) FAAHCYP2D6MAPTCYP2C9CYP2C19
SCHEMBL9691656 0.74 ALDH1A1 (0.39) FAAHCYP2D6MAPTCYP2C9CYP2C19
Secosubamolide SCHEMBL4373980 0.72 EP300 (0.42) ZDHHC7EP300FAAHTP53CYP1A2
Secokotomolide A SCHEMBL29747263 0.72 EP300 (0.42) ZDHHC7EP300FAAHTP53CYP1A2
Secosubamolide SCHEMBL29746935 0.72 EP300 (0.42) ZDHHC7EP300FAAHTP53CYP1A2

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
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed