SCHEMBL12894356

SCHEMBL12894356

CCOc1ccccc1OCc1ccccc1C(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 6/20 0.50
▸ MAPT P10636 3/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ RXRA P19793 1/20 0.43
▸ RXRB P28702 1/20 0.43
▸ RXRG P48443 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ HTR1A P08908 2/20 0.43
▸ ADRA1D P25100 2/20 0.43
▸ ADRA1A P35348 2/20 0.43
▸ ADRA1B P35368 2/20 0.43
▸ PKM P14618 1/20 0.43
▸ NISCH Q9Y2I1 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ ATM Q13315 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ RECQL P46063 1/20 0.42

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
SCHEMBL12894355 0.86 ABCB1 (0.47) MAPTRXRARXRBRXRGALDH1A1
SCHEMBL12894338 0.86 L3MBTL1 (0.50) L3MBTL1MAPTNPSR1RXRARXRB
SCHEMBL12894353 0.83 CDK4 (0.44) L3MBTL1MAPTRXRARXRBRXRG
SCHEMBL12920480 0.82 RXRA (0.47) MAPTRXRARXRBRXRGNISCH
SCHEMBL12894337 0.81 MCL1 (0.49) L3MBTL1MAPTNPSR1RXRARXRB
SCHEMBL6763906 0.81 CYP1A2 (0.53) L3MBTL1MAPTNPSR1RXRARXRB
SCHEMBL18161386 0.79 KDM4E (0.47) ALDH1A1NISCHTDP1MEN1KMT2A
SCHEMBL12894342 0.79 MAPT (0.45) L3MBTL1MAPTRXRARXRBRXRG
SCHEMBL12894334 0.78 IDO1 (0.40) L3MBTL1MAPTNPSR1RXRARXRB
SCHEMBL13794516 0.78 L3MBTL1 (0.67) L3MBTL1MAPTNPSR1ALDH1A1HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7879889-B2 administering (2S)-2-{[(2S)-2-hydroxy-3,3-dimethylbutanoyl]amino}-N-{5-[2-(phenoxymethyl)phenyl]-1,3-thiazol-2-yl}pentanamide, for the treatment of Alzheimer's disease SANOFI-AVENTIS (FR) 2011-02-01 — — US disclosed
US-7879889-B2 administering (2S)-2-{[(2S)-2-hydroxy-3,3-dimethylbutanoyl]amino}-N-{5-[2-(phenoxymethyl)phenyl]-1,3-thiazol-2-yl}pentanamide, for the treatment of Alzheimer's disease SANOFI-AVENTIS (FR) 2011-02-01 — — US disclosed
US-20090253753-A1 Therapeutic Use of Acylaminothiazole Derivatives SANOFI-AVENTIS (FR) 2009-10-08 — — US disclosed
US-20090253753-A1 Therapeutic Use of Acylaminothiazole Derivatives SANOFI-AVENTIS (FR) 2009-10-08 — — US disclosed
US-7563903-B2 Acylaminothiazole derivatives, their preparation and their therapeutic use SANOFI-AVENTIS (FR) 2009-07-21 — — 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 (1 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-20090253753-A1 Therapeutic Use of Acylaminothiazole Derivatives ACAT1, GLS2, GLS L3MBTL1 1882/4885MAPT 1489/4885NPSR1 347/4885

“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.

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