SCHEMBL4124926

SCHEMBL4124926

CC(C)(C)[Si](C)(C)OCc1c(OCc2cccnc2)ccc2c(CCC3CCN(C(=O)O)CC3)noc12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.41
HTT P42858 2/20 0.39
MAPT P10636 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
BCHE P06276 3/20 0.37
PIK3CD O00329 2/20 0.36
PRKDC P78527 2/20 0.36
P2RY12 Q9H244 1/20 0.36
PIK3CA P42336 1/20 0.36
PIK3CB P42338 1/20 0.36
PIK3CG P48736 1/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
GRIN2B Q13224 1/20 0.35
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
CHRM4 P08173 1/20 0.35

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
SCHEMBL4126974 0.92 GPR119 (0.40) ACHEHTTMAPTNPC1RAB9A
SCHEMBL4127264 0.87 ACHE (0.41) ACHENPC1RAB9ABCHEGRIN2B
SCHEMBL4132191 0.86 ACHE (0.38) ACHEHTTBCHECYP3A4CYP2D6
SCHEMBL4126334 0.86 ACHE (0.36) ACHEBCHECHRM4
SCHEMBL4120533 0.85 ACHE (0.41) ACHEBCHE
SCHEMBL13596559 0.83 GPR119 (0.42) ACHE
SCHEMBL4112826 0.82 ACHE (0.41) ACHEBCHE
SCHEMBL13596556 0.82 GPR119 (0.41) ACHEHTTMAPTNPC1RAB9A
SCHEMBL4124936 0.81 HTT (0.39) ACHEHTTMAPTNPC1RAB9A
SCHEMBL4119957 0.81 ACHE (0.48) 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 3716/4885HTT 3905/4885MAPT 4157/4885

“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.