SCHEMBL25830937

SCHEMBL25830937

C#CCOCCOCCOCCN1CCC(N)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.41
GNAO1 P09471 1/20 0.41
GNAI1 P63096 1/20 0.41
HRH1 P35367 3/20 0.39
HRH3 Q9Y5N1 3/20 0.39
HRH2 P25021 2/20 0.39
HTR2A P28223 1/20 0.34
KDM4E B2RXH2 2/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
LTA4H P09960 2/20 0.32
SPHK1 Q9NYA1 1/20 0.31
BCHE P06276 1/20 0.31
MAOA P21397 1/20 0.31
ACHE P22303 1/20 0.31
MAOB P27338 1/20 0.31
HTR2C P28335 1/20 0.31
CHRM2 P08172 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
SCHEMBL26993048 1.00 GNAI3 (0.41) GNAI3GNAO1GNAI1HRH1HRH3
SCHEMBL24533526 0.80 KDM4E (0.40) HRH3KDM4EKMT2ALTA4H
SCHEMBL22783677 0.79 ALOX15 (0.46) KDM4ETSHR
SCHEMBL22777240 0.79 CHRM2 (0.35) HTR2ATSHRHTR2CCHRM2CHRM4
SCHEMBL22777411 0.79 HRH3 (0.40) HRH1HRH3HRH2HTR2ATSHR
SCHEMBL22783637 0.78 KEAP1 (0.40)
SCHEMBL24533464 0.78 HRH3 (0.41) HRH1HRH3HRH2HTR2ATSHR
SCHEMBL24533466 0.78 HRH3 (0.41) HRH1HRH3HRH2HTR2ATSHR
SCHEMBL24481186 0.77 GNAI3 (0.53) GNAI3GNAO1GNAI1HRH1HRH3
SCHEMBL16826736 0.77 GNAI3 (0.53) GNAI3GNAO1GNAI1HRH1HRH3

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-2023125806-A1 CONJUGATE FOR PREVENTING AND TREATING VIRAL INFECTIONS AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2023-07-06 WO disclosed