SCHEMBL31424901

SCHEMBL31424901

CC(C)OCCCc1ccc[nH]c1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 1/20 0.36
▸ MPO P05164 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ BLM P54132 2/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ CASP3 P42574 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ SENP8 Q96LD8 1/20 0.36
▸ SENP7 Q9BQF6 1/20 0.36
▸ SENP6 Q9GZR1 1/20 0.36
▸ DAO P14920 1/20 0.34
▸ AURKA O14965 1/20 0.34
▸ AURKB Q96GD4 1/20 0.34
▸ INCENP Q9NQS7 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 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
SCHEMBL9234355 0.77 DAO (0.45) MAPTBLMDAOAURKAAURKB
SCHEMBL10692239 0.76 DAO (0.41) MAPTBLMDAOAURKAAURKB
SCHEMBL14021923 0.75 DAO (0.40) MAPTBLMNPSR1DAOAURKA
SCHEMBL15794861 0.75 DAO (0.39) MAPTBLMDAOAURKAAURKB
SCHEMBL2495417 0.75 GPR84 (0.46) DAOAURKAAURKBINCENPALDH1A1
SCHEMBL9752575 0.74 DAO (0.42) MAPTBLMDAOAURKAAURKB
SCHEMBL5166986 0.73 GPR84 (0.49) ALDH1A1KDM4ETHRBMCL1
SCHEMBL10764266 0.73 GPR84 (0.49) ALDH1A1KDM4ETHRBMCL1
SCHEMBL28243243 0.73 GPR84 (0.49) ALDH1A1KDM4ETHRBMCL1
SCHEMBL14974903 0.73 GPR84 (0.49) ALDH1A1KDM4ETHRBMCL1

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-119432114-A Azo disperse dye and preparation method thereof 蓬莱嘉信染料化工股份有限公司 2025-02-14 — — CN disclosed
Send feedback