SCHEMBL7052944

SCHEMBL7052944

C=CC(O)[n+]1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 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
Hydrochloric Acid SCHEMBL8919518 0.97 HDAC8 (0.32) HDAC8
Hydrochloric Acid SCHEMBL8922699 0.97 HDAC8 (0.32) HDAC8
SCHEMBL11880213 0.75 HDAC8 (0.31) HDAC8
SCHEMBL1695333 0.72
SCHEMBL4701356 0.69 CYP2C19 (0.34)
SCHEMBL18035806 0.68
SCHEMBL6136744 0.68
SCHEMBL10697550 0.68
SCHEMBL8827254 0.68
SCHEMBL11229951 0.68

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
JP-2004256461-A N-HYDROXYALKYLPYRIDINIUM SALT AND METHOD FOR PRODUCING THE SAME KOEI CHEM CO LTD 2004-09-16 JP disclosed