SCHEMBL28759092

SCHEMBL28759092

CC(N)c1ccncc1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 1/20 0.40
EP300 Q09472 1/20 0.37
KAT2B Q92831 1/20 0.37
KAT8 Q9H7Z6 1/20 0.37
KDM4E B2RXH2 5/20 0.34
MAPKAPK2 P49137 2/20 0.34
TDP1 Q9NUW8 5/20 0.33
RECQL P46063 4/20 0.33
MAPT P10636 3/20 0.33
LMNA P02545 2/20 0.33
ROCK2 O75116 2/20 0.33
ROCK1 Q13464 2/20 0.33
AOC1 P19801 2/20 0.33
AOC3 Q16853 2/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
THPO P40225 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL26106701 0.83 EP300 (0.37) RPS6KA3EP300KAT2BKAT8KDM4E
SCHEMBL26106699 0.83 EP300 (0.37) RPS6KA3EP300KAT2BKAT8KDM4E
SCHEMBL12379212 0.83 RPS6KA3 (0.50) RPS6KA3EP300KAT2BKAT8KDM4E
Hydrochloric Acid SCHEMBL26107272 0.82 EP300 (0.36) RPS6KA3EP300KAT2BKAT8KDM4E
Hydrochloric Acid SCHEMBL26107267 0.82 EP300 (0.36) RPS6KA3EP300KAT2BKAT8KDM4E
SCHEMBL13029049 0.77 SIRT3 (0.38) RPS6KA3TDP1LMNAAOC1AOC3
SCHEMBL17403394 0.76 TSHR (0.57) RPS6KA3TDP1MAPTLMNAALOX15
SCHEMBL25662311 0.76 EP300 (0.35) RPS6KA3EP300KAT2BKAT8KDM4E
SCHEMBL14121041 0.75 LMNA (0.48) RPS6KA3LMNAAOC1AOC3NFKB1
SCHEMBL13028991 0.75 LMNA (0.48) RPS6KA3LMNAAOC1AOC3NFKB1

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
CN-114615976-A Kappa opioid receptor peptide amide agonists 人福医药美国公司 2022-06-10 CN disclosed