SCHEMBL7617060

SCHEMBL7617060

[c]1c[nH]c(CCCC2CCCCCC2)n1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CEL P19835 1/20 0.36
CYP1A2 P05177 1/20 0.36
SIGMAR1 Q99720 3/20 0.35
HRH3 Q9Y5N1 3/20 0.35
GPR84 Q9NQS5 1/20 0.34
DAO P14920 1/20 0.33
HRH4 Q9H3N8 1/20 0.33

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
SCHEMBL7615538 1.00 CEL (0.36) CELCYP1A2SIGMAR1HRH3GPR84
SCHEMBL7620235 0.98 HRH3 (0.36) CELCYP1A2SIGMAR1HRH3GPR84
SCHEMBL7625870 0.95 HRH3 (0.36) CELHRH3
SCHEMBL7624059 0.92 HRH3 (0.37) HRH3
SCHEMBL7617332 0.90 DAO (0.38) CELHRH3DAOHRH4
SCHEMBL6208066 0.90 DAO (0.38) CELHRH3DAOHRH4
SCHEMBL7625880 0.81 HRH3 (0.34) HRH3DAO
SCHEMBL7621930 0.80 HRH4 (0.43) HRH3DAOHRH4
SCHEMBL7620211 0.80 HRH4 (0.43) HRH3DAOHRH4
SCHEMBL30578654 0.75 TBXAS1 (0.44) CELCYP1A2SIGMAR1HRH3

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