SCHEMBL19088727

SCHEMBL19088727

CC1C(=O)C2=C(CCCC2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
KMT2A Q03164 1/20 0.39
TRIM24 O15164 2/20 0.35
TRIM33 Q9UPN9 2/20 0.35
ALDH1A1 P00352 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
SCHEMBL13811067 0.69 CA1 (0.57) CA1CA2CA4KMT2ATRIM24
SCHEMBL31113396 0.67 CA1 (0.38) CA1CA2CA4KMT2A
SCHEMBL11299741 0.66 KMT2A (0.40) CA1CA2CA4KMT2ATRIM24
SCHEMBL46223 0.65 ALDH1A1 (0.38) KMT2ATRIM24TRIM33ALDH1A1
SCHEMBL10351240 0.65
SCHEMBL10638515 0.63 TRIM24 (0.47) CA1CA2CA4TRIM24TRIM33
SCHEMBL677600 0.63
SCHEMBL13906871 0.60 MAPT (0.32)
SCHEMBL18642871 0.60 TRIM24 (0.50) CA1KMT2ATRIM24TRIM33ALDH1A1
SCHEMBL12224711 0.60

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-20170190819-A1 POLYMERIZABLE COMPOSITION AND FILM USING THE SAME DIC CORPORATION (JP) 2017-07-06 US disclosed