SCHEMBL4688142

SCHEMBL4688142

CCC(=O)c1csc(C(N)=O)n1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 2/20 0.45
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 3/20 0.38
NPC1 O15118 2/20 0.38
ALDH1A1 P00352 2/20 0.38
RAB9A P51151 2/20 0.38
HTR2B P41595 1/20 0.35
CYP2C19 P33261 2/20 0.35
ACHE P22303 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
MAPK1 P28482 1/20 0.33
GFER P55789 1/20 0.33
NR1I2 O75469 1/20 0.32
AHR P35869 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL25446548 0.84 PLA2G4A (0.46) PLA2G4AMEN1KMT2AMAPTNPC1
SCHEMBL22462576 0.84 PLA2G4A (0.54) PLA2G4AMEN1KMT2AMAPTNPC1
SCHEMBL9296956 0.82 PLA2G4A (0.39) PLA2G4AMEN1KMT2AMAPTNPC1
SCHEMBL22462526 0.82 PLA2G4A (0.45) PLA2G4AMEN1KMT2AMAPTNPC1
SCHEMBL2745784 0.81 HTR2B (0.49) PLA2G4AMEN1KMT2AMAPTNPC1
SCHEMBL4683786 0.79 KDM1A (0.46) PLA2G4AMEN1KMT2AMAPTNPC1
SCHEMBL22462630 0.78 MAPT (0.53) PLA2G4AMEN1KMT2AMAPTNPC1
SCHEMBL2642436 0.78 ALDH1A1 (0.60) PLA2G4AMEN1KMT2AMAPTNPC1
SCHEMBL2643079 0.77 RAB9A (0.47) PLA2G4AMEN1KMT2AMAPTNPC1
SCHEMBL17712058 0.77 PLA2G4A (0.50) PLA2G4AALDH1A1HTR2BACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7427635-B2 Substituted hydantoins HOFFMANN-LA ROCHE INC. (US) 2008-09-23 US claimed
EP-1781649-B1 SUBSTITUTED HYDANTOINS HOFFMANN LA ROCHE (CH) 2008-08-13 EP claimed
EP-1781649-A2 SUBSTITUTED HYDANTOINS F. Hoffmann-Roche AG (CH) 2007-05-09 EP claimed
US-20060041146-A1 Substituted hydantoins HOFFMANN-LA ROCHE AG 2006-02-23 US claimed
WO-2006018188-A2 SUBSTITUTED HYDANTOINS F. HOFFMANN-LA ROCHE AG (CH) 2006-02-23 WO claimed
US-7427635-B2 Substituted hydantoins HOFFMANN-LA ROCHE INC. (US) 2008-09-23 US disclosed
EP-1781649-B1 SUBSTITUTED HYDANTOINS HOFFMANN LA ROCHE (CH) 2008-08-13 EP disclosed
EP-1781649-A2 SUBSTITUTED HYDANTOINS F. Hoffmann-Roche AG (CH) 2007-05-09 EP disclosed
US-20060041146-A1 Substituted hydantoins HOFFMANN-LA ROCHE AG 2006-02-23 US disclosed
WO-2006018188-A2 SUBSTITUTED HYDANTOINS F. HOFFMANN-LA ROCHE AG (CH) 2006-02-23 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-20060041146-A1 Substituted hydantoins HNMT, MAPK6, KYNU PLA2G4A 1314/4885MEN1 460/4885KMT2A 118/4885

“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.