SCHEMBL7782331

SCHEMBL7782331

FC1(F)CCC2CCCCC2C1(F)F

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL31756487 0.70 HSD17B10 (0.31)
SCHEMBL7782362 0.70 ALDH1A1 (0.35) ALDH1A1
SCHEMBL8390019 0.70 ALDH1A1 (0.30) ALDH1A1
SCHEMBL1377090 0.67 ALDH1A1 (0.35) ALDH1A1
SCHEMBL9238242 0.67 ALDH1A1 (0.32) ALDH1A1
SCHEMBL15992760 0.65 ALDH1A1 (0.30) ALDH1A1
SCHEMBL24233879 0.64 ALDH1A1 (0.47) ALDH1A1
SCHEMBL11560173 0.63 HSD17B10 (0.33) ALDH1A1
SCHEMBL1131303 0.62
SCHEMBL7785055 0.62 ALDH1A1 (0.32) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140734-A1 PREPARATION OF SELECTIVELY FLUORINATED ORGANIC COMPOUNDS F2 Chemicals Limited (GB) 2001-10-10 EP disclosed
WO-2001028959-A1 PREPARATION OF SELECTIVELY FLUORINATED ORGANIC COMPOUNDS F2 CHEMICALS LTD. (GB) 2001-04-26 WO disclosed