SCHEMBL9617320

SCHEMBL9617320

N#CC1(F)C=CC=CC1CC(=O)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.31

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
SCHEMBL9618037 1.00 HSD11B1 (0.31) HSD11B1
SCHEMBL6471572 0.76 HSD11B1 (0.31) HSD11B1
SCHEMBL4063063 0.75
SCHEMBL17099928 0.70
SCHEMBL905316 0.68 CYP1A2 (0.33)
SCHEMBL9815333 0.68
SCHEMBL10706424 0.67 CYP1A2 (0.33)
SCHEMBL7468947 0.66 HSD11B1 (0.30) HSD11B1
SCHEMBL4761755 0.66
SCHEMBL4760587 0.64

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
JP-4026664-A None JP disclosed
JP-H0426664-A ALPHA-FLUORO-ALPHA-CYANO ACETIC ACID DERIVATIVE DAI ICHI PURE CHEM CO LTD 1992-01-29 JP disclosed