SCHEMBL25816575

SCHEMBL25816575

CN(CCOCCNC(=O)C1(C)CC1)CCOCCNC(=O)C1(C)CC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.42
ACHE P22303 12/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
RORC P51449 1/20 0.35
EPHX2 P34913 1/20 0.33
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL25816704 0.93 CHRM2 (0.39) CHRM2ACHEMEN1KMT2ARORC
SCHEMBL25817180 0.91 ACHE (0.39) CHRM2ACHERORCEPHX2CYP3A4
SCHEMBL25837186 0.84 CYP3A4 (0.37) CHRM2ACHEEPHX2CYP3A4CYP2C19
SCHEMBL25817185 0.83 CYP3A4 (0.37) MEN1KMT2ARORCCYP3A4CYP2C19
SCHEMBL23373023 0.81 MEN1 (0.38) CHRM2ACHEMEN1KMT2AEPHX2
SCHEMBL25816682 0.78 HPGD (0.44) MEN1KMT2ACYP3A4CYP2C19SMN1; SMN2
SCHEMBL25817168 0.77 HPGD (0.47) EPHX2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL25816839 0.77 HPGD (0.43) CYP3A4CYP2C19SMN1; SMN2
SCHEMBL25816562 0.75 SMN1; SMN2 (0.44) ACHEMEN1KMT2ASMN1; SMN2
SCHEMBL25816847 0.74 SMN1; SMN2 (0.42) ACHEMEN1KMT2ASMN1; SMN2

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