SCHEMBL6161683

SCHEMBL6161683

CSC(=S)[C@@H]1CC(=O)N(Cc2ccc(Oc3ccc(F)cc3)nc2)C1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.48
EGLN1 Q9GZT9 2/20 0.45
MLNR O43193 2/20 0.42
HCRTR1 O43613 1/20 0.42
HCRTR2 O43614 1/20 0.42
ALDH1A1 P00352 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KMT2A Q03164 1/20 0.39
HRH3 Q9Y5N1 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
RXFP3 Q9NSD7 1/20 0.39
LMNA P02545 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL6160366 0.83 EGLN1 (0.47) HTTEGLN1MLNRHCRTR1HCRTR2
SCHEMBL6160758 0.81 EGLN1 (0.51) HTTEGLN1MLNRHCRTR1HCRTR2
SCHEMBL6158886 0.81 EGLN1 (0.48) HTTEGLN1MLNRHCRTR1HCRTR2
SCHEMBL6158883 0.81 EGLN1 (0.48) HTTEGLN1MLNRHCRTR1HCRTR2
SCHEMBL6161160 0.80 EGLN1 (0.46) HTTEGLN1MLNRHCRTR1HCRTR2
SCHEMBL6160335 0.80 EGLN1 (0.48) HTTEGLN1MLNRHCRTR1HCRTR2
SCHEMBL6162075 0.79 EGLN1 (0.51) HTTEGLN1MLNRHCRTR1HCRTR2
SCHEMBL6160356 0.79 EGLN1 (0.46) HTTEGLN1MLNRHCRTR1HCRTR2
Hydrochloric Acid SCHEMBL6159472 0.79 EGLN1 (0.50) HTTEGLN1MLNRHCRTR1HCRTR2
Hydrochloric Acid SCHEMBL6159638 0.79 EGLN1 (0.50) HTTEGLN1MLNRHCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050165064-A1 Novel thiol derivative, process for producing the same and use thereof TAKEDA PHARMACEUTICALS NORTH AMERICA, INC. 2005-07-28 US disclosed
EP-1500658-A1 NOVEL THIOL DERIVATIVE, PROCESS FOR PRODUCING THE SAME AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2005-01-26 EP 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-20050165064-A1 Novel thiol derivative, process for producing the same and use thereof TST, QSOX1, MMP1 HTT 581/4885EGLN1 841/4885MLNR 4388/4885

“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.