SCHEMBL4824520

SCHEMBL4824520

CN1C(C)(C)CC(OC(=O)CCc2cc(-n3nc4ccccc4n3)c(O)c(C(C)(C)C)c2)CC1(C)C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.40
MAOA P21397 2/20 0.40
ACHE P22303 1/20 0.39
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
GAA P10253 6/20 0.37
HTT P42858 2/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
AGTR1 P30556 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PKM P14618 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
F2R P25116 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL9374944 0.91 MAOB (0.39) MAOBMAOAACHEKMT2AMEN1
SCHEMBL4822395 0.91 MAOB (0.36) MAOBMAOAACHEKMT2AMEN1
SCHEMBL4825189 0.90 MAOB (0.38) MAOBMAOAACHEKMT2AMEN1
SCHEMBL4820165 0.89 MAOB (0.36) MAOBMAOAACHEKMT2AMEN1
SCHEMBL11076378 0.88 NPC1 (0.35) KMT2AMEN1GAAHTTALDH1A1
SCHEMBL4821028 0.88 MAOB (0.38) MAOBMAOAACHEKMT2AMEN1
SCHEMBL994414 0.86 KMT2A (0.47) MAOBMAOAACHEKMT2AMEN1
SCHEMBL9374601 0.86 MAOB (0.36) MAOBMAOAACHEKMT2AMEN1
SCHEMBL9228813 0.85 MAOB (0.42) MAOBMAOAACHEKMT2AMEN1
SCHEMBL21192287 0.84 MEN1 (0.33) KMT2AMEN1GAAKDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030074833-A1 Benzotriazole/hals molecular combinations and compositions stabilized therewith CIBA SPECIALTY CHEMCIALS CORP. 2003-04-24 US claimed
US-20190229290-A1 HETEROCYCLIC COMPOUND AND ELECTRONIC APPARATUS SAMSUNG DISPLAY CO., LTD. (KR) 2019-07-25 US disclosed
US-7419513-B2 Hindered amine light stabilizers (HALS); for thermoset/thermoplastic resins, photographic applications, pigmented/dyed polypropylene, polyamide/polyester fibers, and for white, dyed, dipped, unscented/scented candle wax against discoloration and fading CIBA SPECIALTY CHEMICALS CORPORATION (US) 2008-09-02 US disclosed
US-20050043543-A1 Benzotriazole/HALS molecular combinations and compositions stabilized therewith WOOD MERVIN G (US) 2005-02-24 US disclosed
US-6846929-B2 Benzotriazole/hals molecular combinations and compositions stabilized therewith CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-01-25 US disclosed
US-20030074833-A1 Benzotriazole/hals molecular combinations and compositions stabilized therewith CIBA SPECIALTY CHEMCIALS CORP. 2003-04-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030074833-A1 Benzotriazole/hals molecular combinations and compositions stabilized therewith TAS1R1, TAS1R2, BRWD1 MAOB 972/4885MAOA 697/4885ACHE 1998/4885
US-20190229290-A1 HETEROCYCLIC COMPOUND AND ELECTRONIC APPARATUS ERCC4, ERCC1, ESD MAOB 50/4885MAOA 17/4885ACHE 513/4885
US-20050043543-A1 Benzotriazole/HALS molecular combinations and compositions stabilized therewith BRWD1, TAS1R2, TAS1R1 MAOB 787/4885MAOA 690/4885ACHE 1900/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.