SCHEMBL28992248

SCHEMBL28992248

CC(C)N(CCOP(N)(=O)OCCN(C(C)C)C(C)C)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
LTA4H P09960 1/20 0.32
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL28992261 0.86
SCHEMBL28992249 0.83 CHRM2 (0.34) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL27256342 0.78 LPAR3 (0.42) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL3988371 0.77 MEN1 (0.34) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL4454861 0.77 MEN1 (0.34) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL7456978 0.75 CHRM2 (0.38) CHRM2CHRM1CHRM3CHRNB2CHRNA4
SCHEMBL14346049 0.74 MEN1 (0.32) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL7159583 0.74 TSHR (0.34) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL14346014 0.74 MEN1 (0.32) MEN1KMT2ACHRM2CHRM1CHRM3
Phosphoric Acid SCHEMBL28675446 0.74 LPAR3 (0.38) MEN1KMT2ACHRM2CHRM1CHRM3

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
CN-110325543-B Cyclic dinucleotides as STING (stimulator of interferon genes) agonists 武田药品工业株式会社 2023-03-31 CN disclosed