SCHEMBL4121282

SCHEMBL4121282

CN(C)Cc1c(OCC2CC2)ccc2c(CCC3CCN(c4ccncc4)CC3)noc12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.40
MELK Q14680 3/20 0.34
BCHE P06276 1/20 0.34
F10 P00742 3/20 0.33
SLC6A9 P48067 1/20 0.33
PDGFRA P16234 1/20 0.32
FLT3 P36888 1/20 0.32
HASPIN Q8TF76 1/20 0.32
DRD2 P14416 1/20 0.32
DRD3 P35462 1/20 0.32

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
Hydrochloric Acid SCHEMBL4122371 0.99 ACHE (0.39) ACHEMELKBCHEF10SLC6A9
SCHEMBL4125432 0.92 ACHE (0.46) ACHEBCHEDRD2DRD3
SCHEMBL4120316 0.90 ACHE (0.39) ACHEMELKBCHEDRD2DRD3
Hydrochloric Acid SCHEMBL4130168 0.89 ACHE (0.39) ACHEMELKBCHEDRD2DRD3
SCHEMBL4122006 0.89 ACHE (0.42) ACHEBCHEDRD2
SCHEMBL4120022 0.88 ACHE (0.42) ACHEBCHE
Hydrochloric Acid SCHEMBL4120147 0.88 ACHE (0.41) ACHEBCHEDRD2
SCHEMBL13597350 0.87 ACHE (0.46) ACHEBCHE
Hydrochloric Acid SCHEMBL4129877 0.87 ACHE (0.42) ACHEBCHE
SCHEMBL4127158 0.86 ACHE (0.45) 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 4 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
US-20090318690-A1 Benzisoxazole Compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-12-24 US disclosed
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 3716/4885MELK 2436/4885BCHE 2215/4885

“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.