SCHEMBL27414997

SCHEMBL27414997

CCC(O)CNCCCNCC(O)CC

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.44
KDM4E B2RXH2 2/20 0.39
CYP2C19 P33261 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
GLA P06280 1/20 0.39
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 4/20 0.35
ANPEP P15144 2/20 0.34
ERAP2 Q6P179 1/20 0.34
TSHR P16473 4/20 0.33
SAT1 P21673 1/20 0.32
KDM1A O60341 2/20 0.32
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL11765569 0.95 PKM (0.50) PKMKDM4ECYP2C19KMT2AMEN1
SCHEMBL11765853 0.92 PKM (0.48) PKMKDM4ECYP2C19KMT2ACYP1A2
SCHEMBL12977299 0.91 PKM (0.39) PKMKDM4ECYP2C19KMT2AMEN1
SCHEMBL2242929 0.90 TSHR (0.46) PKMKDM4EKMT2AALDH1A1ANPEP
SCHEMBL27415012 0.89 KDM4E (0.42) PKMKDM4EKMT2AALDH1A1ANPEP
SCHEMBL4293846 0.88 PKM (0.40) PKMKDM4EKMT2AMEN1ALDH1A1
SCHEMBL17351928 0.88 TSHR (0.52) PKMKDM4EALDH1A1ANPEPERAP2
SCHEMBL24459668 0.86 ANPEP (0.50) PKMALDH1A1ANPEPERAP2TSHR
SCHEMBL6249621 0.86 ANPEP (0.50) PKMALDH1A1ANPEPERAP2TSHR
SCHEMBL7325532 0.86 ANPEP (0.50) PKMALDH1A1ANPEPERAP2TSHR

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-2024119037-A1 NOVEL IONIZABLE LIPIDS AND LIPID NANOPARTICLES COMPRISING THE SAME UNIVERSITY OF CINCINNATI (US) 2024-06-06 WO disclosed