SCHEMBL9546023

SCHEMBL9546023

C=C(C)C(=O)OC1([SiH2]F)CCCCO1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34

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
SCHEMBL27908327 0.86 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9546428 0.83
SCHEMBL3923631 0.78
SCHEMBL28906906 0.73 TSHR (0.36) ALDH1A1
SCHEMBL733610 0.72 ALDH1A1 (0.33) ALDH1A1
SCHEMBL27488173 0.71 ALDH1A1 (0.32) ALDH1A1
SCHEMBL440901 0.70 ALDH1A1 (0.31) ALDH1A1
SCHEMBL10432430 0.69
SCHEMBL26133634 0.69
SCHEMBL16241670 0.69 ALDH1A1 (0.39) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4149235-A None JP disclosed
JP-4159319-A None JP disclosed
JP-4154825-A None JP disclosed
WO-1993023773-A1 PROCESS FOR PREPARATION OF OXYGEN PERMEABLE POLYMER MATERIAL CIBA-GEIGY AG (CH) 1993-11-25 WO disclosed
JP-H04159319-A PRODUCTION OF OXYGEN-PASSABLE POLYMERIC MATERIAL JAPAN SYNTHETIC RUBBER CO LTD 1992-06-02 JP disclosed
JP-H04154825-A PRODUCTION OF OXYGEN-PASSABLE POLYMERIC MATERIAL JAPAN SYNTHETIC RUBBER CO LTD 1992-05-27 JP disclosed
JP-H04149235-A PRODUCTION OF OXYGEN-PASSABLE POLYMERIC MATERIAL JAPAN SYNTHETIC RUBBER CO LTD 1992-05-22 JP disclosed