SCHEMBL25540401

SCHEMBL25540401

COC(=O)CCCCCN(C)CCN1CCNCC1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 2/20 0.45
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
PAOX Q6QHF9 1/20 0.38
SIGMAR1 Q99720 2/20 0.38
LTA4H P09960 1/20 0.37
TSHR P16473 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HRH2 P25021 1/20 0.36
HRH1 P35367 1/20 0.36
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
GLA P06280 1/20 0.35
MAPT P10636 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
SCHEMBL9293161 0.84 PAOX (0.49) KMT2AMEN1PAOXTSHRSMN1; SMN2
Hydrochloric Acid SCHEMBL9462599 0.83 PAOX (0.47) KMT2AMEN1PAOXTSHRSMN1; SMN2
Hydrochloric Acid SCHEMBL18263836 0.83 PAOX (0.47) KMT2AMEN1PAOXTSHRSMN1; SMN2
SCHEMBL31465622 0.82 MEN1 (0.48) KMT2AMEN1PAOXTSHRSMN1; SMN2
SCHEMBL7310808 0.81 MEN1 (0.49) KMT2AMEN1PAOXTSHRSMN1; SMN2
Hydrochloric Acid SCHEMBL28437307 0.79 MEN1 (0.48) KMT2AMEN1PAOXTSHRSMN1; SMN2
SCHEMBL18499076 0.79 KMT2A (0.65) KDM5AKMT2AMEN1LTA4HTSHR
SCHEMBL29069237 0.78 MEN1 (0.40) KDM5AKMT2AMEN1SIGMAR1SMN1; SMN2
SCHEMBL6603043 0.77 SMN1; SMN2 (0.56) KMT2AMEN1SIGMAR1TSHRSMN1; SMN2
SCHEMBL20333441 0.76 SIGMAR1 (0.48) SIGMAR1GNAI3GNAO1GNAI1

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-2023091787-A1 NOVEL IONIZABLE LIPIDS AND LIPID NANOPARTICLES AND METHODS OF USING THE SAME SENDA BIOSCIENCES, INC. (US) 2023-05-25 WO disclosed