SCHEMBL6156530

SCHEMBL6156530

COC(=O)CCc1cccc(Oc2cccc(/C=N/NC(=S)Nc3ccc(Cl)c(Cl)c3)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.51
ALDH1A1 P00352 4/20 0.51
GAA P10253 4/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
POLB P06746 2/20 0.51
NPSR1 Q6W5P4 2/20 0.46
MEN1 O00255 4/20 0.46
MAPT P10636 6/20 0.43
MAPK1 P28482 1/20 0.43
STAT3 P40763 1/20 0.43
STAT1 P42224 1/20 0.43
LMNA P02545 1/20 0.42
ASF1A Q9Y294 1/20 0.42
TP53 P04637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL6153416 0.91 KMT2A (0.52) KMT2AALDH1A1GAASMN1; SMN2NPC1
SCHEMBL6153460 0.80 RRM1 (0.56) KMT2AALDH1A1GAASMN1; SMN2NPC1
SCHEMBL6154622 0.78 SMN1; SMN2 (0.55) KMT2AALDH1A1GAASMN1; SMN2NPC1
SCHEMBL7516731 0.74 MAPT (0.47) KMT2AALDH1A1GAASMN1; SMN2NPC1
SCHEMBL6154670 0.72 MAOA (0.46) ALDH1A1NPC1RAB9A
SCHEMBL6153669 0.70 KMT2A (0.49) KMT2AALDH1A1GAASMN1; SMN2NPC1
SCHEMBL6153812 0.69 SMN1; SMN2 (0.49) KMT2AALDH1A1GAASMN1; SMN2NPC1
SCHEMBL9804265 0.69 FFAR1 (0.60)
SCHEMBL6665515 0.67 MAPT (0.52) KMT2AALDH1A1GAASMN1; SMN2NPC1
SCHEMBL3066819 0.66 TSHR (0.58) SMN1; SMN2POLBLMNAL3MBTL1

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-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2005-03-24 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-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases PTPRS, PTPRJ, PTPRCAP KMT2A 875/4885ALDH1A1 961/4885GAA 2365/4885

“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.