SCHEMBL25840255

SCHEMBL25840255

CCCCCCCCCCCCSSCCN(CCCN(C)CCCN(CCSSCCCCCCCCCCCC)CCSSCCCCCCCCCCCC)CCSSCCCCCCCCCCCC

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
S1PR5 Q9H228 1/20 0.38
DNM1 Q05193 3/20 0.37
GGPS1 O95749 4/20 0.36
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
KDM5A P29375 2/20 0.33
KDM4C Q9H3R0 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
FDPS P14324 1/20 0.32
AGTR1 P30556 1/20 0.32
OPRM1 P35372 1/20 0.32
PDE3A Q14432 1/20 0.32
CHRM2 P08172 1/20 0.31
TSHR P16473 1/20 0.31
THRB P10828 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
SCHEMBL25840252 0.89 DNM1 (0.52) DNM1TSHRTHRB
SCHEMBL25840250 0.89 DNM1 (0.52) DNM1TSHRTHRB
SCHEMBL25840345 0.87 ALDH1A1 (0.34) S1PR2S1PR1S1PR3S1PR5KDM5A
SCHEMBL25840253 0.87 ALDH1A1 (0.34) S1PR2S1PR1S1PR3S1PR5KDM5A
SCHEMBL25840476 0.87 ALDH1A1 (0.34) S1PR2S1PR1S1PR3S1PR5KDM5A
SCHEMBL25840249 0.86 PLA2G1B (0.37) DNM1TSHRTHRB
SCHEMBL25840247 0.82 DNM1 (0.48) DNM1TSHRTHRB
SCHEMBL23424081 0.81 DNM1 (0.50) S1PR2S1PR1S1PR3S1PR5DNM1
SCHEMBL25056693 0.81 DNM1 (0.33) DNM1TSHRTHRB
SCHEMBL23390600 0.81 DNM1 (0.50) S1PR2S1PR1S1PR3S1PR5DNM1

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-2023136688-A1 IONIZABLE LIPID CONTAINING BIODEGRADABLE DISULFIDE BOND AND LIPID NANOPARTICLES COMPRISING SAME 에스티팜 주식회사 2023-07-20 WO disclosed