SCHEMBL28511491

SCHEMBL28511491

O=c1[nH]cc(C2NCCS2)c(=O)[nH]1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ DPYD Q12882 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ GAA P10253 2/20 0.36
▸ ATAD2 Q6PL18 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ CYP19A1 P11511 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ THPO P40225 1/20 0.36
▸ MTOR P42345 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ HBB P68871 1/20 0.36
▸ PMP22 Q01453 1/20 0.36
▸ ERN1 O75460 1/20 0.35
▸ KDM4C Q9H3R0 1/20 0.33

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
SCHEMBL3561548 0.69 DPYD (0.45) MAPTSMN1; SMN2DPYDALDH1A1GAA
SCHEMBL7758271 0.66 GAA (0.47) MAPTSMN1; SMN2DPYDALDH1A1GAA
SCHEMBL17687568 0.65 GAA (0.50) MAPTSMN1; SMN2DPYDALDH1A1GAA
SCHEMBL30534773 0.60 DPYD (0.36) MAPTSMN1; SMN2DPYDALDH1A1GAA
SCHEMBL8951248 0.60 MAPT (0.44) MAPTSMN1; SMN2TDP1ALDH1A1GAA
SCHEMBL7744554 0.60 MAPT (0.53) MAPTSMN1; SMN2TDP1ALDH1A1ERN1
SCHEMBL3396242 0.60 MAPT (0.53) MAPTSMN1; SMN2TDP1ALDH1A1GAA
SCHEMBL19337221 0.59 GAA (0.36) MAPTSMN1; SMN2DPYDALDH1A1GAA
SCHEMBL7598686 0.59 ALDH1A1 (0.49) MAPTSMN1; SMN2DPYDALDH1A1GAA
SCHEMBL28982471 0.59 MAPT (0.40) MAPTSMN1; SMN2TDP1ALDH1A1ERN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113151261-A Antisense oligonucleotides as inhibitors of TGF-R signaling 神经视觉医药有限公司 2021-07-23 — — CN disclosed
CN-107002082-B Antisense oligonucleotides as inhibitors of TGF-R signaling 神经视觉医药有限公司 2021-02-02 — — CN disclosed
Send feedback