SCHEMBL29317405

SCHEMBL29317405

CC(C)OCCOCCOCCN1CCNCC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
SIGMAR1 Q99720 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CXCR4 P61073 2/20 0.39
POLB P06746 1/20 0.36
LTA4H P09960 1/20 0.35
CHRM5 P08912 1/20 0.34
CHRM3 P20309 1/20 0.34

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
SCHEMBL12605242 1.00 SMN1; SMN2 (0.46) SMN1; SMN2SIGMAR1MEN1KMT2AKDM4E
SCHEMBL20328696 0.93 SMN1; SMN2 (0.44) SMN1; SMN2SIGMAR1MEN1KMT2ACXCR4
SCHEMBL20328701 0.90 SMN1; SMN2 (0.44) SMN1; SMN2SIGMAR1MEN1KMT2AKDM4E
SCHEMBL8042099 0.89 SIGMAR1 (0.53) SMN1; SMN2SIGMAR1MEN1KMT2ACXCR4
SCHEMBL20328703 0.86 SMN1; SMN2 (0.44) SMN1; SMN2SIGMAR1MEN1KMT2AALDH1A1
SCHEMBL2621583 0.85 SMN1; SMN2 (0.49) SMN1; SMN2SIGMAR1MEN1KMT2AALDH1A1
SCHEMBL20322411 0.85 KDM4E (0.39) SMN1; SMN2SIGMAR1MEN1KMT2AKDM4E
SCHEMBL20333243 0.85 MEN1 (0.41) SMN1; SMN2SIGMAR1MEN1KMT2AKDM4E
SCHEMBL20328691 0.83 KDM4E (0.46) SMN1; SMN2MEN1KMT2AKDM4EALDH1A1
SCHEMBL23987984 0.82 CXCR4 (0.52) SMN1; SMN2SIGMAR1MEN1KMT2AKDM4E

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
EP-4397661-A1 COMPOUND FOR DEGRADATION OF BCL-2 FAMILY PROTEINS AND MEDICAL APPLICATION THEREOF Xizang Haisco Pharmaceutical Co., Ltd. (CN) 2024-07-10 EP disclosed