SCHEMBL27675268

SCHEMBL27675268

NCCOC(=O)N1C=CC=CC=C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.33
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30
CNR1 P21554 1/20 0.30

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
Hydrochloric Acid SCHEMBL4077835 0.72 MAOB (0.33)
SCHEMBL10570793 0.66
SCHEMBL27908187 0.65 POLB (0.38) IDO1ALDH1A1MAPT
SCHEMBL1449854 0.65 ALDH1A1 (0.40) IDO1ALDH1A1MAPTTHRBCNR1
SCHEMBL20705301 0.65 IDO1 (0.36) IDO1ALDH1A1MAPTTHRBCNR1
SCHEMBL21670363 0.64 ALDH1A1 (0.42) ALDH1A1THRB
Hydrochloric Acid SCHEMBL28664937 0.63 IDO1 (0.39) IDO1ALDH1A1MAPTTHRBCNR1
SCHEMBL5672376 0.63
Hydrochloric Acid SCHEMBL11664482 0.63 IDO1 (0.39) IDO1ALDH1A1MAPTTHRBCNR1
SCHEMBL189780 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1972932-A Compounds and methods for treating dyslipidemia LILLY CO ELI (US) 2007-05-30 CN claimed
CN-1972932-A Compounds and methods for treating dyslipidemia LILLY CO ELI (US) 2007-05-30 CN disclosed