SCHEMBL4126867

SCHEMBL4126867

O=C(O)N1CCC(CCc2noc3c(CO)c(OCc4ccc(Cl)c(Cl)c4)ccc23)CC1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 16/20 0.41
PPARG P37231 2/20 0.38
PPARD Q03181 2/20 0.38
PPARA Q07869 2/20 0.38
BCHE P06276 3/20 0.38
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
S1PR1 P21453 1/20 0.37
S1PR5 Q9H228 1/20 0.37
PREP P48147 1/20 0.36

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
SCHEMBL4125364 0.91 ACHE (0.41) ACHEPPARGPPARDPPARABCHE
SCHEMBL4113058 0.90 EPHA2 (0.41) ACHEPPARGPPARDPPARA
SCHEMBL4119957 0.88 ACHE (0.48) ACHEBCHE
SCHEMBL4122115 0.88 ACHE (0.42) ACHEBCHEPREP
Dimethylamine SCHEMBL4125369 0.87 ACHE (0.41) ACHEBCHES1PR1S1PR5
SCHEMBL4124707 0.85 ACHE (0.44) ACHEBCHEPREP
SCHEMBL4133717 0.84 ACHE (0.47) ACHEBCHE
SCHEMBL4113252 0.84 ACHE (0.42) ACHEBCHE
SCHEMBL4127326 0.83 EPHA2 (0.40) ACHEPPARGPPARDPPARANR1H2
SCHEMBL4130208 0.82 ACHE (0.42) ACHEPPARGPPARDPPARABCHE

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-20090318690-A1 Benzisoxazole Compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-12-24 US disclosed
EP-2017275-A1 BENZISOXAZOLE COMPOUND Eisai R&D Management Co., Ltd. (JP) 2009-01-21 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-20090318690-A1 Benzisoxazole Compound NR1I2, NR1I3, NR0B1 ACHE 3716/4885PPARG 498/4885PPARD 924/4885

“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.