SCHEMBL5329424

SCHEMBL5329424

C=CCC1C(=O)NC(=S)NC1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 1.00
MAPT P10636 5/20 0.51
HPGD P15428 3/20 0.51
POLB P06746 1/20 0.51
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 2/20 0.48
PKM P14618 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.35
GAA P10253 1/20 0.31
MAPK1 P28482 1/20 0.31
SIRT2 Q8IXJ6 1/20 0.30
TOP2A P11388 1/20 0.30
SLC22A12 Q96S37 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL472480 0.84 ALDH1A1 (0.72) ALDH1A1MAPTHPGDPOLBMEN1
SCHEMBL17294189 0.82 ALDH1A1 (0.69) ALDH1A1MAPTHPGDPOLBMEN1
SCHEMBL17651926 0.81 ALDH1A1 (0.68) ALDH1A1MAPTHPGDPOLBMEN1
SCHEMBL1598193 0.78 ALDH1A1 (0.64) ALDH1A1MAPTHPGDPOLBMEN1
SCHEMBL11168067 0.71 ALDH1A1 (0.63) ALDH1A1MAPTHPGDPOLBMEN1
SCHEMBL22790519 0.69 ALDH1A1 (0.52) ALDH1A1
SCHEMBL9280423 0.69 ALDH1A1 (0.52) ALDH1A1
SCHEMBL14660246 0.69 ALDH1A1 (0.52) ALDH1A1MAPTHPGDPOLBMEN1
SCHEMBL1154518 0.69 ALDH1A1 (0.52) ALDH1A1MAPTHPGDL3MBTL1GAA
SCHEMBL1483113 0.69 ALDH1A1 (0.52) ALDH1A1MAPTHPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10285914-B2 Bonding method, bonding kit, and bonding material TOKUYAMA DENTAL CORPORATION (JP) 2019-05-14 US disclosed
US-20170156991-A1 BONDING METHOD, BONDING KIT, AND BONDING MATERIAL TOKUYAMA DENTAL CORPORATION (JP) 2017-06-08 US disclosed
US-20170156991-A1 BONDING METHOD, BONDING KIT, AND BONDING MATERIAL TOKUYAMA DENTAL CORPORATION (JP) 2017-06-08 US disclosed
WO-2007048710-A1 ANIONIC ALKYLTHIOBARBITURIC ACID BASED AZO METAL COMPLEX DYES AND THEIR USE IN OPTICAL LAYERS FOR OPTICAL DATA RECORDING CLARIANT INTERNATIONAL LTD (CH) 2007-05-03 WO disclosed
WO-2007048710-A1 ANIONIC ALKYLTHIOBARBITURIC ACID BASED AZO METAL COMPLEX DYES AND THEIR USE IN OPTICAL LAYERS FOR OPTICAL DATA RECORDING CLARIANT INTERNATIONAL LTD (CH) 2007-05-03 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 (2 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-10285914-B2 Bonding method, bonding kit, and bonding material SUV39H1, SUV39H2, EZH1 ALDH1A1 946/4885MAPT 3142/4885HPGD 2177/4885
US-20170156991-A1 BONDING METHOD, BONDING KIT, AND BONDING MATERIAL SUV39H1, SUV39H2, EZH1 ALDH1A1 946/4885MAPT 3142/4885HPGD 2177/4885

“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.