SCHEMBL9566773

SCHEMBL9566773

NCC(=O)CCOC(=O)Oc1ccc(CO)nc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.30
KMT2A Q03164 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
SCHEMBL9566752 0.85 ALDH1A1 (0.32) MAPTKMT2A
SCHEMBL9566853 0.84 CYSLTR2 (0.32) MAPTKMT2A
SCHEMBL9566735 0.81 LNPEP (0.31)
SCHEMBL26093046 0.74 KMT2A (0.41) MAPTKMT2A
SCHEMBL9566840 0.69 KDM4E (0.34) MAPT
SCHEMBL1758566 0.69 ALDH1A1 (0.40)
SCHEMBL5568443 0.67 RAB9A (0.56) KMT2A
SCHEMBL2904971 0.66 POLB (0.44) MAPTKMT2A
SCHEMBL9566800 0.65 SMN1; SMN2 (0.52)
SCHEMBL23538182 0.65 CCR1 (0.34)

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-0533130-A1 2-Hydroxymethylpyridines, the corresponding pyridine-N-oxides and derivatives thereof, process for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-24 EP disclosed