SCHEMBL5987366

SCHEMBL5987366

NC(=O)CSc1cc[c]cc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.60
ALDH1A1 P00352 4/20 0.55
FFAR1 O14842 1/20 0.42
KMT2A Q03164 2/20 0.39
STAT3 P40763 1/20 0.38
MEN1 O00255 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
MAPT P10636 1/20 0.35
HSD17B10 Q99714 1/20 0.35
RAB9A P51151 1/20 0.35
PPARG P37231 1/20 0.35
NCOA1 Q15788 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL646450 0.81 FFAR1 (0.65) SMN1; SMN2ALDH1A1FFAR1KMT2AMEN1
SCHEMBL1170312 0.78 FFAR1 (0.68) SMN1; SMN2ALDH1A1FFAR1KMT2ASTAT3
SCHEMBL8746034 0.77 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1FFAR1KMT2ASTAT3
Hydrochloric Acid SCHEMBL3043801 0.77 FFAR1 (0.65) SMN1; SMN2ALDH1A1FFAR1KMT2ASTAT3
SCHEMBL7835806 0.77 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1FFAR1KMT2ASTAT3
SCHEMBL3735703 0.75 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1FFAR1KMT2ACA12
SCHEMBL11212870 0.75 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL11217371 0.75 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1KMT2AMEN1RAB9A
SCHEMBL1395735 0.75 SMN1; SMN2 (0.66) SMN1; SMN2ALDH1A1KMT2AMEN1HSD17B10
SCHEMBL11212921 0.75 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT

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-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2006-06-22 US claimed

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-20060135483-A1 Oxygen/nitrogen heterocycle inhibitors of tyrosine phosphatases PTPRO, PTPRG, PTPN1 SMN1; SMN2 1565/4885ALDH1A1 1227/4885FFAR1 3633/4885

“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.