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Sugi Predict / Compounds / SCHEMBL17714636

SCHEMBL17714636

SCHEMBL17714636

Cc1cc(Cc2cc(C)c(-n3c(=O)c4cc5c(=O)n(Cn6c(=O)c7cc8c(=O)n(C)c(=O)c8cc7c6=O)c(=O)c5cc4c3=O)c(C)c2)cc(C)c1C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.33
▸ TTR P02766 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
SCHEMBL17637568 0.93 TTR (0.33) ALDH1A1TTR
SCHEMBL17637567 0.89 TTR (0.32) TTR
SCHEMBL17676434 0.82 TTR (0.31) ALDH1A1TTR
SCHEMBL18165673 0.78 ANPEP (0.38) TTR
SCHEMBL17714637 0.75 ALDH1A1 (0.52) ALDH1A1
SCHEMBL14278359 0.75 — —
SCHEMBL10045214 0.75 ALDH1A1 (0.31) ALDH1A1
SCHEMBL15745684 0.73 PGR (0.32) TTR
SCHEMBL17676433 0.69 NPEPPS (0.32) ALDH1A1TTR
SCHEMBL13105167 0.67 ALDH1A1 (0.40) ALDH1A1

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
US-9327248-B1 Copolyimide membranes with high permeability and selectivity for olefin/paraffin separations UOP LLC (US) 2016-05-03 — — US disclosed