SCHEMBL31706232

SCHEMBL31706232

COC(=O)c1cnc(C2CCNCC2)s1.COC(=O)c1cnc(C2CCNCC2)s1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLAT P00750 3/20 0.41
HTR2C P28335 1/20 0.41
CRBN Q96SW2 2/20 0.39
HRH3 Q9Y5N1 2/20 0.38
MAP4K3 Q8IVH8 3/20 0.37
TLR9 Q9NR96 2/20 0.36
TLR8 Q9NR97 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CHEK1 O14757 1/20 0.35
CHEK2 O96017 1/20 0.35
HCRTR2 O43614 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 1/20 0.35
DDB1 Q16531 1/20 0.34
FFAR2 O15552 1/20 0.34
TLR7 Q9NYK1 1/20 0.34
GSK3B P49841 1/20 0.34
DYRK1A Q13627 1/20 0.34

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
SCHEMBL14164237 1.00 PLAT (0.41) PLATHTR2CCRBNHRH3MAP4K3
SCHEMBL22579415 0.90 HRH3 (0.41) CRBNHRH3MEN1KMT2AHCRTR2
SCHEMBL31705326 0.85 HCRTR2 (0.48) PLATMAP4K3HCRTR2
SCHEMBL15376175 0.85 HCRTR2 (0.48) PLATMAP4K3HCRTR2
SCHEMBL31704833 0.83 LRRK2 (0.40) CRBNHRH3HCRTR2FFAR2
SCHEMBL14164278 0.83 HRH3 (0.38) CRBNHRH3MEN1KMT2AHCRTR2
SCHEMBL22048060 0.83 CRBN (0.41) CRBNHRH3MEN1KMT2AHCRTR2
SCHEMBL14164274 0.82 HRH3 (0.37) CRBNHRH3MEN1KMT2AHCRTR2
SCHEMBL14164234 0.82 HRH3 (0.42) CRBNHRH3CHEK1CHEK2HCRTR2
SCHEMBL3658788 0.80 SLC6A2 (0.42) MEN1KMT2AHCRTR2CHRNB2CHRNA4

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-2025215110-A1 NEW AMIDE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USES AS SOS1 INHIBITORS LES LABORATOIRES SERVIER (FR) 2025-10-16 WO disclosed