SCHEMBL7564849

SCHEMBL7564849

CC1=C(C(=O)O)C(C(=O)O)(C(=O)NO)CCC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 12/20 0.33
CYP1A2 P05177 1/20 0.33
HAO1 Q9UJM8 1/20 0.32
RARB P10826 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
SCHEMBL673147 0.86 CYP1A2 (0.39) CYP1A2HAO1RARB
SCHEMBL486947 0.79 CYP1A2 (0.37) CYP1A2HAO1RARB
SCHEMBL11277113 0.71 CYP1A2 (0.41) CYP1A2HAO1RARB
SCHEMBL9342959 0.70 CYP1A2 (0.51) CYP1A2HAO1RARB
SCHEMBL19433833 0.70 CYP1A2 (0.40) CYP1A2HAO1RARB
SCHEMBL9133413 0.69
SCHEMBL3264588 0.67 CYP2C19 (0.30)
SCHEMBL19433853 0.62 CYP1A2 (0.33) CYP1A2
SCHEMBL19433841 0.62 CYP1A2 (0.34) CYP1A2HAO1RARB
SCHEMBL757738 0.62 POLB (0.35) CYP1A2

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-20020052447-A1 Rubber-containing sytrenic resin and process for producing the same DAICEL CHEMICAL INDUSTRIES, LTD. 2002-05-02 US disclosed
US-6333381-B1 MORPHOLOGY AND THE PARTICLE SIZE OF RUBBER PARTICLES DISPERSED IN A STYRENIC RESIN ARE CONTROLLABLE; IMPROVING THE IMPACT RESISTANCE; SURFACE GLOSS; GRAFT POLYMERS; DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2001-12-25 US disclosed
CN-1254722-A Styrene resin containing rubber and preparing process thereof DAICEL CHEM (JP) 2000-05-31 CN disclosed
EP-1002812-A1 Rubber-containing styrenic resin and process for producing the same Daicel Chemical Industries, Ltd. (JP) 2000-05-24 EP disclosed