SCHEMBL18560100

SCHEMBL18560100

CB(O)c1cc(C#N)cc(B(O)O)c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 4/20 0.52
TTR P02766 2/20 0.39
ALB P02768 2/20 0.39
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
P4HB P07237 1/20 0.32

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
SCHEMBL15602898 0.89 ENPP2 (0.61) ENPP2TTRALBMEN1KMT2A
SCHEMBL27908 0.84 ENPP2 (0.61) ENPP2TTRALBMEN1KMT2A
SCHEMBL15459219 0.82 CA2 (0.39) ENPP2
SCHEMBL16398417 0.79 ENPP2 (0.52) ENPP2TTRALBMEN1KMT2A
SCHEMBL29952148 0.77 ENPP2 (0.53) ENPP2TTRALBMEN1KMT2A
SCHEMBL29954891 0.76 ENPP2 (0.48) ENPP2TTRALBMEN1KMT2A
SCHEMBL3326314 0.75 ENPP2 (0.52) ENPP2TTRALBMEN1KMT2A
SCHEMBL2377148 0.75 ENPP2 (0.52) ENPP2TTRALBMEN1KMT2A
SCHEMBL874242 0.75 ENPP2 (0.52) ENPP2
SCHEMBL16516876 0.75 ENPP2 (0.52) ENPP2TTRALBMEN1KMT2A

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
EP-2711949-B9 Compounds having hole conducting property, co-adsorbent body comprising same, and dye-sensitized solar cell comprising the co-adsorbent body UNIV KOREA RES & BUS FOUND (KR) 2017-03-01 EP disclosed