SCHEMBL29956789

SCHEMBL29956789

O=CCCCCCc1c[nH]cn1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
HIF1A Q16665 1/20 0.31
FAAH O00519 2/20 0.31
TRPV1 Q8NER1 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
SCHEMBL7002161 0.98 HIF1A (0.32) TSHRHIF1A
SCHEMBL22533668 0.93 HIF1A (0.33) HIF1A
SCHEMBL1117288 0.85
SCHEMBL7961089 0.83
Histamine SCHEMBL1021058 0.83 HIF1A (0.33) TSHRHIF1A
SCHEMBL4379723 0.82 TDP1 (0.40) TSHR
SCHEMBL5322896 0.78 HRH4 (0.32)
SCHEMBL2000950 0.77 ADH1B (0.35)
SCHEMBL25317586 0.76
SCHEMBL25316852 0.76

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed