SCHEMBL4133377

SCHEMBL4133377

OCC(O)c1c(OCC2CC2)ccc2c(CCC3CCN(c4ccc(Cl)nn4)CC3)noc12

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 15/20 0.37
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
BCHE P06276 2/20 0.33
CYP1A2 P05177 1/20 0.30

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
SCHEMBL13596222 0.90 ACHE (0.38) ACHELMNAHTTMEN1KMT2A
SCHEMBL4124618 0.83 ACHE (0.41) ACHELMNAHTTMEN1KMT2A
SCHEMBL4125743 0.83 ACHE (0.39) ACHELMNAHTTMEN1KMT2A
SCHEMBL4124614 0.81 ACHE (0.39) ACHELMNAHTTMEN1KMT2A
SCHEMBL4112904 0.81 ACHE (0.39) ACHELMNAHTTMEN1KMT2A
SCHEMBL4120913 0.81 ACHE (0.39) ACHELMNAHTTMEN1KMT2A
SCHEMBL4112912 0.81 ACHE (0.39) ACHELMNAHTTMEN1KMT2A
SCHEMBL4127857 0.77 MEN1 (0.35) ACHELMNAHTTMEN1KMT2A
SCHEMBL13597484 0.72 ACHE (0.43) ACHEBCHE
SCHEMBL4121348 0.70 ACHE (0.41) ACHEBCHE

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 3716/4885LMNA 3162/4885HTT 3905/4885

“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.