SCHEMBL4152447

SCHEMBL4152447

O=C(C1CCSCC1)N1CCCC(c2nc(-c3ccc(F)cc3)no2)C1

nearest known ligand 0.83

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.71
CLPP Q16740 1/20 0.71
HSD11B1 P28845 5/20 0.69
POLB P06746 1/20 0.65
TSHR P16473 2/20 0.65
PKM P14618 1/20 0.65
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
CYP1A2 P05177 1/20 0.63
CYP3A4 P08684 1/20 0.63
CYP2C9 P11712 1/20 0.63
CYP2C19 P33261 1/20 0.63
MAPT P10636 1/20 0.61
MAPK1 P28482 1/20 0.61
LMNA P02545 1/20 0.59

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
SCHEMBL4152444 1.00 GRM5 (0.71) GRM5CLPPHSD11B1POLBTSHR
SCHEMBL415297 0.92 HSD11B1 (0.78) GRM5CLPPHSD11B1POLBTSHR
SCHEMBL193948 0.92 HSD11B1 (0.78) GRM5CLPPHSD11B1POLBTSHR
SCHEMBL4151196 0.91 HSD11B1 (0.80) GRM5CLPPHSD11B1POLBTSHR
SCHEMBL4151187 0.91 HSD11B1 (0.80) GRM5CLPPHSD11B1POLBTSHR
SCHEMBL4130483 0.89 GRM5 (0.72) GRM5CLPPHSD11B1POLBTSHR
SCHEMBL4130486 0.89 GRM5 (0.72) GRM5CLPPHSD11B1POLBTSHR
SCHEMBL193323 0.87 GRM5 (0.70) GRM5CLPPHSD11B1POLBTSHR
SCHEMBL193322 0.87 GRM5 (0.70) GRM5CLPPHSD11B1POLBTSHR
SCHEMBL193680 0.83 GRM5 (1.00) GRM5CLPPHSD11B1POLBTSHR

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-20090197897-A1 Novel Oxadiazole Derivatives and Their Use as Positive Allosteric Modulators of Metabotropic Glutamate Receptors ADDEX PHARMA SA (CH) 2009-08-06 US claimed
US-20090197897-A1 Novel Oxadiazole Derivatives and Their Use as Positive Allosteric Modulators of Metabotropic Glutamate Receptors ADDEX PHARMA SA (CH) 2009-08-06 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-20090197897-A1 Novel Oxadiazole Derivatives and Their Use as Positive Allosteric Modulators of Metabotropic Glutamate Receptors GRM5, GRM2, GRM3 GRM5 1/4885CLPP 4656/4885HSD11B1 3098/4885

“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.