SCHEMBL2636052

SCHEMBL2636052

NC(=O)C1SCCN1C(=O)c1ncsc1-c1cccc(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 13/20 0.51
HCRTR2 O43614 13/20 0.51
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GRM5 P41594 2/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL2635330 0.88 HCRTR2 (0.51) HCRTR1HCRTR2
SCHEMBL2056674 0.88 CYP1A2 (0.49) HCRTR1HCRTR2GRM5
SCHEMBL2636054 0.86 HCRTR1 (0.49) HCRTR1HCRTR2GRM5RECQL
SCHEMBL2635815 0.85 HCRTR1 (0.45) HCRTR1HCRTR2RAB9ASMN1; SMN2
SCHEMBL2636405 0.82 HCRTR2 (0.39) HCRTR1HCRTR2
SCHEMBL2634914 0.82 HCRTR1 (0.55) HCRTR1HCRTR2
SCHEMBL2057132 0.81 HCRTR1 (0.38) HCRTR1HCRTR2RAB9ASMN1; SMN2
SCHEMBL2635322 0.80 HCRTR1 (0.50) HCRTR1HCRTR2
SCHEMBL2056937 0.77 HCRTR1 (0.47) HCRTR1HCRTR2RAB9ASMN1; SMN2RECQL
SCHEMBL1572592 0.75 HCRTR1 (0.43) HCRTR1HCRTR2RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110105491-A1 THIAZOLIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2011-05-05 US claimed
WO-2010004507-A1 THIAZOLIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2010-01-14 WO claimed
US-20110105491-A1 THIAZOLIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2011-05-05 US disclosed
WO-2010004507-A1 THIAZOLIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2010-01-14 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-20110105491-A1 THIAZOLIDINE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, OXTR HCRTR1 2/4885HCRTR2 1/4885RAB9A 3080/4885

“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.