SCHEMBL12894342

SCHEMBL12894342

Cc1cccc(OCc2ccccc2C(C)(C)C)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.45
▸ MAPK1 P28482 3/20 0.45
▸ TDP1 Q9NUW8 3/20 0.45
▸ L3MBTL1 Q9Y468 3/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ TSHR P16473 2/20 0.44
▸ HTR1B P28222 1/20 0.44
▸ RAB9A P51151 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ CASP3 P42574 1/20 0.43
▸ SENP8 Q96LD8 1/20 0.43
▸ SENP7 Q9BQF6 1/20 0.43
▸ SENP6 Q9GZR1 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ CDK4 P11802 1/20 0.41
▸ CCND1 P24385 1/20 0.41
▸ RXRA P19793 1/20 0.40
▸ RXRB P28702 1/20 0.40

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
SCHEMBL12894353 0.89 CDK4 (0.44) MAPTMAPK1TDP1L3MBTL1MEN1
SCHEMBL12894343 0.82 SCN8A (0.46) TSHRLMNAALDH1A1GABRA1GABRB2
SCHEMBL12894338 0.79 L3MBTL1 (0.50) MAPTL3MBTL1ALDH1A1RXRARXRB
SCHEMBL12894356 0.79 L3MBTL1 (0.50) MAPTMAPK1TDP1L3MBTL1MEN1
SCHEMBL13793631 0.79 MAPT (0.49) MAPTMAPK1TDP1L3MBTL1MEN1
SCHEMBL12894355 0.79 ABCB1 (0.47) MAPTRAB9ANPC1ALDH1A1RXRA
SCHEMBL18161386 0.78 KDM4E (0.47) TDP1MEN1KMT2AHTR1BALDH1A1
SCHEMBL1837035 0.78 MAPT (0.50) MAPTMAPK1TDP1L3MBTL1MEN1
SCHEMBL8617382 0.78 MAPT (0.47) MAPTMAPK1TDP1L3MBTL1MEN1
SCHEMBL31093939 0.78 MAPT (0.50) MAPTMAPK1TDP1L3MBTL1MEN1

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 MAPT 1489/4885MAPK1 4469/4885TDP1 3467/4885

“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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