SCHEMBL23735628

SCHEMBL23735628

CC(C)N(C(C)C)P(OCCC#N)OCCCCCC(=O)N1CCC[C@H]1C(=O)COCCC#N

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.38
HTR1A P08908 2/20 0.31
HTR7 P34969 2/20 0.31
HTR2A P28223 1/20 0.30
HTR6 P50406 1/20 0.30
DPP4 P27487 1/20 0.30

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
SCHEMBL23735587 0.87 SPHK1 (0.37) SPHK1HTR1AHTR7
SCHEMBL23735610 0.87 SPHK1 (0.37) SPHK1HTR1AHTR7
SCHEMBL23735636 0.87 SPHK1 (0.37) SPHK1HTR1AHTR7
SCHEMBL22968334 0.79 L3MBTL1 (0.40)
SCHEMBL23735657 0.76 FKBP1A (0.41) HTR1AHTR7DPP4
SCHEMBL23735605 0.76 FKBP1A (0.41) HTR1AHTR7DPP4
SCHEMBL23735608 0.76 FKBP1A (0.41) HTR1AHTR7DPP4
SCHEMBL12258832 0.75 DPP4 (0.34) DPP4
SCHEMBL12258834 0.75 DPP4 (0.34) DPP4
SCHEMBL16328978 0.72

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-3862431-A1 METHOD FOR PRODUCING HAIRPIN SINGLE-STRAND RNA MOLECULES Toray Industries, Inc. (JP) 2021-08-11 EP disclosed