SCHEMBL8564289

SCHEMBL8564289

O=C(OCl)c1c(Cl)c(Cl)c(C(=O)OCl)c(C(=O)OCl)c1C(=O)OCl

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33

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
SCHEMBL990565 0.94 CES2 (0.39) CES2CES1
SCHEMBL5849902 0.85 HTT (0.40) CES2CES1
SCHEMBL28622150 0.81 KDM4E (0.33) CES2CES1
SCHEMBL28410963 0.77 CYP1A2 (0.33)
SCHEMBL29108816 0.76 ALDH1A1 (0.37)
SCHEMBL29997411 0.76 MEN1 (0.40)
SCHEMBL10609570 0.73 ALDH1A1 (0.35)
SCHEMBL7027660 0.72 ALDH1A1 (0.33)
SCHEMBL11297882 0.71 ALDH1A1 (0.37)
SCHEMBL5334826 0.69 CA12 (0.46) CES2CES1

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-5760128-A REACTING POLYESTER-POLYOL WITH POLYISOCYANATE TO FORM CROSSLINKED MICROPARTICLES, INCORPORATING INTO PIGMENTED BASECOAT, APPLYING TO SUBSTRATE, FORMING FILM, APPLYING TRANSPARENT TOPCOAT, STOVING BASF LACKE (DE) 1998-06-02 US disclosed