SCHEMBL22649507

SCHEMBL22649507

CCCCCNc1c(N(C)C)c(=S)c1=S

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DNM2 P50570 11/20 0.36
MMP3 P08254 1/20 0.36
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EPHX1 P07099 1/20 0.31
SLC29A1 Q99808 1/20 0.30
GPR84 Q9NQS5 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
SCHEMBL21231253 0.98 DNM2 (0.39) DNM2MMP3ALDH1A1TSHREPHX1
SCHEMBL22645847 0.86
SCHEMBL21231196 0.86 MMP3 (0.34) DNM2MMP3ALDH1A1TSHRSMN1; SMN2
SCHEMBL22943378 0.85 EPHX1 (0.31) EPHX1
SCHEMBL24807494 0.84 MMP3 (0.36) DNM2MMP3EPHX1
SCHEMBL22645854 0.84 GPR84 (0.34) DNM2MMP3ALDH1A1GPR84
SCHEMBL22645831 0.84 GPR84 (0.34) DNM2MMP3ALDH1A1GPR84
SCHEMBL21231187 0.84 MMP3 (0.35) DNM2MMP3ALDH1A1TSHRSMN1; SMN2
SCHEMBL24806623 0.83 DNM2 (0.36) DNM2MMP3GPR84
SCHEMBL24937234 0.81 TSHR (0.30) 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-2020227510-A1 POLYNUCLEOTIDES FOR DISRUPTING IMMUNE CELL ACTIVITY AND METHODS OF USE THEREOF MODERNATX, INC. (US) 2020-11-12 WO disclosed