SCHEMBL7625870

SCHEMBL7625870

[c]1c[nH]c(CCCC2CCC2)n1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.36
HCAR2 Q8TDS4 2/20 0.32
CEL P19835 1/20 0.31
SLC6A4 P31645 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
SCHEMBL7620235 0.97 HRH3 (0.36) HRH3CEL
SCHEMBL7617060 0.95 CEL (0.36) HRH3CEL
SCHEMBL7615538 0.95 CEL (0.36) HRH3CEL
SCHEMBL7624059 0.93 HRH3 (0.37) HRH3SLC6A4
SCHEMBL7617332 0.85 DAO (0.38) HRH3CEL
SCHEMBL6208066 0.85 DAO (0.38) HRH3CEL
SCHEMBL7625880 0.82 HRH3 (0.34) HRH3
SCHEMBL7621930 0.74 HRH4 (0.43) HRH3
SCHEMBL30578654 0.70 TBXAS1 (0.44) HRH3CEL
SCHEMBL7622787 0.68 HRH3 (0.33) HRH3

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-1232166-A2 SYNTHESIS OF 2'-DEOXY-L-NUCLEOSIDES Pharmasset Limited (US) 2002-08-21 EP disclosed
WO-2001034618-A2 SYNTHESIS OF 2'-DEOXY-L-NUCLEOSIDES PHARMASSET LIMITED (US) 2001-05-17 WO disclosed