SCHEMBL26983176

SCHEMBL26983176

NCCNC(=O)NS(=O)(=O)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.63
CA1 P00915 1/20 0.63
CA2 P00918 1/20 0.63
CA9 Q16790 1/20 0.63
FBP1 P09467 13/20 0.55
ALDH1A1 P00352 2/20 0.51
LMNA P02545 2/20 0.51
TSHR P16473 2/20 0.51
CYP3A4 P08684 1/20 0.51
THRB P10828 1/20 0.51
NFKB1 P19838 1/20 0.51
HTR2A P28223 1/20 0.51
CYP2C19 P33261 1/20 0.51
ADRA1A P35348 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
LARS1 Q9P2J5 1/20 0.50
ALB P02768 1/20 0.50
CYP2C9 P11712 1/20 0.50
TDP1 Q9NUW8 1/20 0.50

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
SCHEMBL5931108 0.85 FBP1 (0.70) CA12CA1CA2CA9FBP1
SCHEMBL2290886 0.83 ALDH1A1 (0.72) CA12CA1CA2CA9FBP1
SCHEMBL21780200 0.82 KDM4E (0.46) CA12CA1CA2CA9ALDH1A1
SCHEMBL184964 0.81 CYP2C9 (0.76) CA12CA1CA2CA9FBP1
SCHEMBL6012074 0.80 CA2 (0.60) CA12CA1CA2CA9LMNA
SCHEMBL11049679 0.80 CYP2C9 (0.69) FBP1ALDH1A1LMNATSHRCYP3A4
SCHEMBL16158153 0.80 LARS1 (0.57) CA12CA1CA2CA9FBP1
Methyl Alcohol SCHEMBL28260710 0.80 CYP2C9 (0.74) CA12CA1CA2CA9FBP1
SCHEMBL10607611 0.79 KDM4E (0.68) CA12CA1CA2CA9FBP1
SCHEMBL28534045 0.78 EPHX2 (0.68) FBP1ALDH1A1LMNATSHRALB

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
US-20240011034-A1 INHIBITION OF miR-29b-3p TO ENHANCE NEURONAL SURVIVAL IN HUNTINGTON'S DISEASE WASHINGTON UNIVERSITY 2024-01-11 US disclosed