SCHEMBL7790720

SCHEMBL7790720

CSc1ccc(C(C#N)=NOS(=O)(=O)c2ccc(C)cc2)cc1SC

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.33
MAPT P10636 4/20 0.33
TDP1 Q9NUW8 3/20 0.33
PKM P14618 3/20 0.33
MAPK1 P28482 2/20 0.33
HTT P42858 2/20 0.33
RAB9A P51151 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 2/20 0.33
HSP90AA1 P07900 1/20 0.33
XBP1 P17861 1/20 0.33
MPI P34949 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HPGD P15428 4/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
CYP1A2 P05177 2/20 0.33
NPC1 O15118 1/20 0.33
NFKB1 P19838 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
SCHEMBL7790716 1.00 ALDH1A1 (0.33) ALDH1A1MAPTTDP1PKMMAPK1
SCHEMBL7790745 0.89 ALDH1A1 (0.38) ALDH1A1MAPTPKMHTTSMN1; SMN2
SCHEMBL7790744 0.89 ALDH1A1 (0.38) ALDH1A1MAPTPKMHTTSMN1; SMN2
SCHEMBL18957974 0.85 ALDH1A1 (0.40) ALDH1A1MAPTTDP1PKMMAPK1
SCHEMBL10083959 0.85 ALDH1A1 (0.40) ALDH1A1MAPTTDP1PKMMAPK1
SCHEMBL10097224 0.85 ALDH1A1 (0.40) ALDH1A1MAPTTDP1PKMMAPK1
SCHEMBL2582376 0.84 ALDH1A1 (0.41) ALDH1A1MAPTTDP1PKMMAPK1
SCHEMBL2582375 0.84 ALDH1A1 (0.41) ALDH1A1MAPTTDP1PKMMAPK1
SCHEMBL10083960 0.83 TCF4 (0.38) ALDH1A1MAPTTDP1PKMMAPK1
SCHEMBL12760555 0.82 MAPT (0.45) ALDH1A1MAPTTDP1PKMMAPK1

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
US-20010037037-A1 Oximesulfonic acid esters and the use thereof as latent sulfonic acids CIBA SPEICIALTY CHEMICALS CORP. 2001-11-01 US disclosed
US-6017675-A POLYMERIZATION CATALYST CIBA SPECIALTY CHEMIALS CORPORATION (US) 2000-01-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010037037-A1 Oximesulfonic acid esters and the use thereof as latent sulfonic acids QSOX1, HAO2, PAH ALDH1A1 160/4885MAPT 4475/4885TDP1 1340/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.