SCHEMBL20002640

SCHEMBL20002640

CCC(O)C1(F)CCCC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL21401950 0.75 TSHR (0.36) TSHR
SCHEMBL8114195 0.72 TSHR (0.32) TSHR
SCHEMBL15345268 0.71
SCHEMBL25973642 0.70
SCHEMBL23114221 0.70 TSHR (0.30) TSHR
SCHEMBL7891972 0.70
SCHEMBL7166749 0.70 IDO1 (0.33) TSHR
SCHEMBL20839289 0.70 IDO1 (0.33) TSHR
SCHEMBL110367 0.70 SLC6A2 (0.33) TSHR
SCHEMBL17633973 0.69

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-2018057973-A1 COMPOUNDS AND METHODS FOR IDO AND TDO MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. (US) 2018-03-29 WO disclosed