SCHEMBL23205759

SCHEMBL23205759

C=C(C)C(=N)C(C)CCC

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
FDPS P14324 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
SCHEMBL30450220 0.80 FDPS (0.39) TSHRFDPS
Hydrochloric Acid SCHEMBL31076153 0.78 FDPS (0.37) TSHRFDPS
SCHEMBL449179 0.74
SCHEMBL17407746 0.74
SCHEMBL15008505 0.71 TSHR (0.41) TSHRFDPS
SCHEMBL21812174 0.70 TSHR (0.36) TSHRFDPS
SCHEMBL4822832 0.69
SCHEMBL23069465 0.69
SCHEMBL8122791 0.69
SCHEMBL99840 0.68

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
WO-2021067604-A1 QUINOLINE INHIBITORS OF RAD52 AND METHODS OF USE DREXEL UNIVERSITY (US) 2021-04-08 WO disclosed