SCHEMBL5524577

SCHEMBL5524577

Cc1ccc(S(=O)(=O)NCCc2cc[c]cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.79
MEN1 O00255 2/20 0.79
KMT2A Q03164 2/20 0.79
SMN1; SMN2 Q16637 1/20 0.55
GAA P10253 1/20 0.52
PPARG P37231 1/20 0.52
TAAR1 Q96RJ0 1/20 0.51
CA12 O43570 1/20 0.51
CA2 P00918 1/20 0.51
CA9 Q16790 1/20 0.51
HSD17B10 Q99714 1/20 0.51
PRMT1 Q99873 1/20 0.51
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
POLB P06746 1/20 0.51

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
SCHEMBL17974011 0.89 ALDH1A1 (1.00) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL10452817 0.84 ALDH1A1 (0.55) ALDH1A1MEN1KMT2ASMN1; SMN2TAAR1
SCHEMBL5187444 0.84 TAAR1 (0.72) ALDH1A1MEN1KMT2ASMN1; SMN2TAAR1
SCHEMBL10453046 0.84 ALDH1A1 (0.55) ALDH1A1MEN1KMT2ASMN1; SMN2PPARG
SCHEMBL9330609 0.84 MEN1 (0.68) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL625181 0.84 ALDH1A1 (0.84) ALDH1A1MEN1KMT2APPARGTAAR1
SCHEMBL5187812 0.84 TDP1 (0.67) ALDH1A1MEN1KMT2ASMN1; SMN2TAAR1
SCHEMBL5188475 0.84 ALDH1A1 (0.81) ALDH1A1MEN1KMT2ASMN1; SMN2PPARG
SCHEMBL6803886 0.81 ALDH1A1 (0.84) ALDH1A1MEN1KMT2ASMN1; SMN2GAA
SCHEMBL29260042 0.81 ALDH1A1 (0.84) ALDH1A1MEN1KMT2ASMN1; SMN2GAA

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-7179832-B2 Glycogen synthase kinase 3β inhibitor, composition and process for the preparation thereof CRYSTALGENOMICS, INC. (KR) 2007-02-20 US disclosed
US-20060079521-A1 Glycogen synthase kinase 3beta inhibitor, composition and process for the preparation thereof CRYSTALGENOMICS, INC. (KR) 2006-04-13 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-20060079521-A1 Glycogen synthase kinase 3beta inhibitor, composition and process for the preparation thereof GSK3B, GSK3A, GYS2 ALDH1A1 3930/4885MEN1 4192/4885KMT2A 2546/4885

“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.