SCHEMBL8251192

SCHEMBL8251192

CC(C)Cc1ccc(OCCN(C)c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.51
PPARG P37231 7/20 0.49
PPARA Q07869 3/20 0.49
KCNH2 Q12809 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 1/20 0.46
TSHR P16473 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
KEAP1 Q14145 1/20 0.43
NFE2L2 Q16236 1/20 0.43
SIGMAR1 Q99720 1/20 0.42
PPARD Q03181 2/20 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
SCHEMBL11675665 0.83 LTA4H (0.73) LTA4HKCNH2CYP1A2CYP2D6CYP2C9
SCHEMBL11676944 0.83 LTA4H (0.55) LTA4HPPARGPPARAKCNH2CYP1A2
SCHEMBL11677652 0.82 LTA4H (0.59) LTA4HKCNH2HTTTSHR
SCHEMBL9326150 0.82 LTA4H (0.54) LTA4HPPARGPPARAKCNH2CYP1A2
SCHEMBL8245062 0.81 TSHR (0.69) LTA4HKCNH2TSHR
SCHEMBL8252741 0.81 HRH3 (0.66) LTA4HKCNH2HRH3KEAP1NFE2L2
SCHEMBL14393747 0.81 KCNH2 (0.54) LTA4HPPARGPPARAKCNH2CYP1A2
SCHEMBL25942906 0.80 ESRRB (0.45) LTA4HPPARGPPARA
SCHEMBL11676355 0.80 TSHR (0.62) LTA4HKCNH2TSHR
SCHEMBL11675851 0.80 LSS (0.65) LTA4HKCNH2CYP1A2CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7786122-B2 α-(N-sulfonamido)acetamide derivatives as β-amyloid inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2010-08-31 US disclosed
US-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2008-04-10 US disclosed
US-7300936-B2 α-(N-sulfonamido)acetamide derivatives as β-amyloid inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-11-27 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-20080085894-A1 ALPHA-(N-SULFONAMIDO)ACETAMIDE DERIVATIVES AS BETA-AMYLOID INHIBITORS APP, APBA1, BACE1 LTA4H 2827/4885PPARG 2808/4885PPARA 914/4885

“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.