SCHEMBL21153524

SCHEMBL21153524

CCOC(=O)NCCOC(C)CCNC

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.41
CHRNB4 P30926 3/20 0.41
CHRNA3 P32297 3/20 0.41
CHRNA4 P43681 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
ACHE P22303 10/20 0.39
GLA P06280 1/20 0.36
KMT2A Q03164 1/20 0.36
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 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
SCHEMBL12783281 0.80 ACHE (0.46) CHRNB2CHRNB4CHRNA3CHRNA4L3MBTL1
SCHEMBL22361585 0.77 L3MBTL1 (0.43) CHRNB2CHRNB4CHRNA3CHRNA4L3MBTL1
SCHEMBL22138601 0.76 ACHE (0.46) L3MBTL1ACHEGLAKMT2A
SCHEMBL14288713 0.75 ACHE (0.47) L3MBTL1ACHEGLAKMT2A
SCHEMBL21152766 0.75 HTR2A (0.32)
SCHEMBL18404646 0.74 KMT2A (0.42) KMT2A
SCHEMBL24514752 0.73 MTNR1A (0.39) L3MBTL1
SCHEMBL10147776 0.72 CHRNB2 (0.46) CHRNB2CHRNB4CHRNA3CHRNA4ACHE
SCHEMBL11141024 0.72 ACHE (0.52) L3MBTL1ACHEGLAKMT2A
SCHEMBL24709364 0.71 KISS1R (0.36)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020132483-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2020-06-25 WO disclosed
WO-2019217591-A1 ANTI-MSR1 ANTIBODIES AND METHODS OF USE THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2019-11-14 WO disclosed
WO-2019136487-A2 STEROIDS AND ANTIBODY-CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2019-07-11 WO disclosed