SCHEMBL6153919

SCHEMBL6153919

COC(=O)Cc1ccc(Oc2cccc(NC(=S)NN)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
CRHBP P24387 2/20 0.51
CRHR2 Q13324 2/20 0.51
ALDH1A1 P00352 4/20 0.50
HPGD P15428 1/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
MAPT P10636 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
LMNA P02545 1/20 0.46
PKM P14618 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL4956695 0.77 MAOB (0.51) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL23220318 0.75 IDO1 (0.68) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
SCHEMBL3192546 0.75 SRD5A2 (0.58) SMN1; SMN2ALDH1A1HPGDKMT2A
SCHEMBL6154909 0.75 SMN1; SMN2 (0.43) SMN1; SMN2ALDH1A1KMT2AMEN1L3MBTL1
Alcohol SCHEMBL28252000 0.74 KMT2A (0.62) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
SCHEMBL6242743 0.74 FFAR1 (0.53) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
SCHEMBL31657190 0.74 AKR1C3 (0.62) ALDH1A1KMT2ARAB9A
SCHEMBL5213552 0.71 SLC7A5 (0.55) SMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL4959727 0.71 MAPT (0.55) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL7558146 0.71 KMT2A (0.56) SMN1; SMN2ALDH1A1KMT2AMEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2005-03-24 US disclosed
EP-1446110-A2 ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES Structural Bioinformatics Inc. (US) 2004-08-18 EP disclosed
WO-2003032916-A2 ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES STRUCTURAL BIOINFORMATICS INC. (US) 2003-04-24 WO 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-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases PTPRS, PTPRJ, PTPRCAP SMN1; SMN2 2211/4885CRHBP 3560/4885CRHR2 4755/4885

“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.