SCHEMBL5556735

SCHEMBL5556735

COC(=O)c1ccc(CSc2cccc(NC(=S)N/N=C/c3cc(OCc4ccccc4)cc(OCc4cccc(C(=O)OC)c4)c3)c2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.48
KDM4E B2RXH2 7/20 0.48
RAB9A P51151 6/20 0.48
NPC1 O15118 5/20 0.48
TDP1 Q9NUW8 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
GAA P10253 8/20 0.47
ALDH1A1 P00352 8/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
KMT2A Q03164 5/20 0.47
POLB P06746 2/20 0.47
MAPK1 P28482 2/20 0.46
STAT3 P40763 1/20 0.46
STAT1 P42224 1/20 0.46
MEN1 O00255 4/20 0.45
PKM P14618 1/20 0.45
THRB P10828 3/20 0.45
RECQL P46063 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
LMNA P02545 2/20 0.44

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
SCHEMBL5556482 0.95 GAA (0.49) MAPTKDM4ERAB9ANPC1TDP1
SCHEMBL5557712 0.85 GAA (0.42) MAPTKDM4ERAB9ANPC1TDP1
SCHEMBL5556614 0.84 KDM4E (0.58) MAPTKDM4ERAB9ANPC1TDP1
SCHEMBL5552796 0.74 MAPT (0.42) MAPTKDM4ERAB9ANPC1TDP1
SCHEMBL6153812 0.74 SMN1; SMN2 (0.49) MAPTKDM4ERAB9ANPC1TDP1
SCHEMBL5552494 0.73 RAB9A (0.48) MAPTKDM4ERAB9ANPC1L3MBTL1
SCHEMBL6663443 0.73 KMT2A (0.49) MAPTKDM4ERAB9ANPC1TDP1
SCHEMBL5552735 0.71 MRGPRX4 (0.59) KDM4ERAB9ANPC1TDP1ALDH1A1
SCHEMBL5558769 0.69 MAPT (0.46) MAPTKDM4ERAB9ANPC1L3MBTL1
SCHEMBL5368105 0.67 MAPT (0.66) MAPTKDM4ERAB9ANPC1TDP1

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-20070197577-A1 Inhibitors of anthrax lethal factor CENGENT THERAPEUTICS (US) 2007-08-23 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-20070197577-A1 Inhibitors of anthrax lethal factor APAF1, ANTXR2, LITAF MAPT 4430/4885KDM4E 3630/4885RAB9A 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.