SCHEMBL28042512

SCHEMBL28042512

C=CC(=CCC)C(C=C)=CCC

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
TSHR P16473 2/20 0.36
TP53 P04637 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL21133402 0.91 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL4584137 0.81
SCHEMBL1446836 0.81
SCHEMBL25160051 0.79
SCHEMBL27337636 0.79
SCHEMBL21422230 0.78
SCHEMBL21769616 0.75
SCHEMBL8201066 0.74 TSHR (0.34) ALDH1A1TSHRLMNA
SCHEMBL28139146 0.74 ALDH1A1 (0.39) ALDH1A1TSHRLMNA
SCHEMBL10344439 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105073766-A Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA INC (US) 2015-11-18 CN disclosed