SCHEMBL24533288

SCHEMBL24533288

NCCSSCCC(=O)ON1C(=O)CCC1=O

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
THPO P40225 1/20 0.32
MAPT P10636 2/20 0.31
EHMT2 Q96KQ7 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL43720 0.92 TSHR (0.34) TSHR
SCHEMBL768869 0.87 TSHR (0.45) TSHRTDP1
SCHEMBL27362202 0.85 TSHR (0.30) TSHR
SCHEMBL13698947 0.84 SMN1; SMN2 (0.33)
SCHEMBL13069250 0.83 PSMB8 (0.35)
SCHEMBL26014291 0.83
SCHEMBL26014299 0.83
SCHEMBL1728021 0.82 PSMB8 (0.32)
SCHEMBL17430393 0.81 KMT2A (0.33)
Mercaptopropionic Acid SCHEMBL1014492 0.81 TSHR (0.35) TSHR

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-2022130046-A1 N-1 BRANCHED IMIDAZOQUINOLINES, CONJUGATES THEREOF, AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-06-23 WO disclosed