SCHEMBL30457747

SCHEMBL30457747

CCCCOc1cc(CCCN(C)C)cc(OCCCC)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.53
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
CNR1 P21554 2/20 0.44
CNR2 P34972 2/20 0.44
LSS P48449 1/20 0.44
THRB P10828 2/20 0.43
THRA P10827 1/20 0.43
MAPT P10636 1/20 0.43
HTR1A P08908 1/20 0.43
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43

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
SCHEMBL16013165 0.83 CNR1 (0.44) CNR1CNR2THRBTHRA
SCHEMBL16013164 0.83 CNR1 (0.44) CNR1CNR2THRBTHRA
Hydrochloric Acid SCHEMBL9735260 0.83 HRH3 (0.72) HRH3KDM4EALDH1A1SMN1; SMN2LSS
SCHEMBL30457592 0.80 HRH3 (0.53) HRH3KDM4EALDH1A1SMN1; SMN2
SCHEMBL19193902 0.80 HRH3 (0.50) HRH3KDM4EALDH1A1SMN1; SMN2THRB
SCHEMBL5267965 0.79 CNR1 (0.46) CNR1CNR2
SCHEMBL31442767 0.77 CNR2 (0.54) CNR1CNR2THRBTHRAHTR1A
SCHEMBL2759077 0.77 PLA2G2A (0.55)
SCHEMBL12333299 0.77 CNR1 (0.44) CNR1CNR2
SCHEMBL11388482 0.76 HRH3 (0.62) HRH3KDM4EALDH1A1SMN1; SMN2LSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4452934-A1 IONIZABLE DISULFIDE LIPIDS AND LIPID NANOPARTICLES DERIVED THEREFROM Providence Therapeutics Holdings Inc. (CA) 2024-10-30 EP disclosed
WO-2023115221-A1 IONIZABLE DILSULFIDE LIPIDS AND LIPID NANOPARTICLES DERIVED THEREFROM PROVIDENCE THERAPEUTICS HOLDINGS INC. (CA) 2023-06-29 WO disclosed