SCHEMBL18872864

SCHEMBL18872864

CC(=O)CCCCCNC(=S)Nc1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc21

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FTO Q9C0B1 7/20 0.65
▸ NAALAD2 Q9Y3Q0 4/20 0.60
▸ JAK2 O60674 1/20 0.56
▸ NQO1 P15559 1/20 0.56
▸ NR1H2 P55055 1/20 0.55
▸ TTR P02766 1/20 0.53
▸ KEAP1 Q14145 1/20 0.52
▸ MIF P14174 1/20 0.51
▸ FOLH1 Q04609 1/20 0.49
▸ DRD1 P21728 1/20 0.48
▸ MAP1LC3B Q9GZQ8 1/20 0.48

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
SCHEMBL20809317 0.93 FTO (0.70) FTONAALAD2JAK2NQO1NR1H2
SCHEMBL15045059 0.92 FTO (0.61) FTONAALAD2JAK2NQO1NR1H2
SCHEMBL8893358 0.92 NAALAD2 (0.62) FTONAALAD2JAK2NQO1NR1H2
SCHEMBL22863319 0.91 NAALAD2 (0.63) FTONAALAD2JAK2NQO1NR1H2
SCHEMBL29353892 0.90 FTO (0.63) FTONAALAD2JAK2NQO1NR1H2
SCHEMBL991216 0.90 FTO (0.63) FTONAALAD2JAK2NQO1NR1H2
SCHEMBL15744221 0.89 FTO (0.64) FTONAALAD2JAK2NQO1NR1H2
SCHEMBL16602999 0.88 NAALAD2 (0.60) FTONAALAD2JAK2NQO1NR1H2
SCHEMBL27016019 0.87 TTR (0.64) FTONAALAD2JAK2NQO1NR1H2
SCHEMBL17956697 0.87 FTO (0.69) FTONAALAD2JAK2NQO1NR1H2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9890197-B2 RHAMM binding peptides LONDON HEALTH SCIENCES CENTRE RESEARCH INC. (CA) 2018-02-13 — — US disclosed
EP-3168226-A2 RHAMM BINDING PEPTIDES London Health Sciences Centre Research Inc. (CA) 2017-05-17 — — EP disclosed
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