SCHEMBL4112459

SCHEMBL4112459

CC(C)(C)OC(=O)N1CCC(CCc2noc3c(CO[Si](C)(C)C(C)(C)C)c(-c4ccco4)ccc23)CC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.41
GPR119 Q8TDV5 7/20 0.40
ADORA2A P29274 3/20 0.39
FAAH O00519 1/20 0.38
ADORA1 P30542 1/20 0.37
ADORA3 P0DMS8 1/20 0.36
ABCB1 P08183 1/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
KDM4E B2RXH2 1/20 0.35
PKM P14618 1/20 0.35
ACHE P22303 1/20 0.35
CSF1R P07333 1/20 0.35
KDR P35968 1/20 0.35
ADA P00813 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
SCHEMBL4116903 0.92 ACHE (0.38) TGFBR1ACHE
SCHEMBL4127514 0.90 GPR119 (0.43) TGFBR1GPR119ADORA2AFAAHADORA1
SCHEMBL4126785 0.88 GPR119 (0.44) TGFBR1GPR119ADORA2AFAAHADORA1
SCHEMBL13596327 0.88 KDM4E (0.41) GPR119FAAHKDM4EPKMACHE
SCHEMBL4126897 0.86 GPR119 (0.40) TGFBR1GPR119FAAHKDM4EPKM
SCHEMBL4122119 0.86 GPR119 (0.47) GPR119FAAH
SCHEMBL4115147 0.86 GPR119 (0.43) GPR119FAAHKDM4EPKMACHE
SCHEMBL4112768 0.86 GPR119 (0.40) GPR119FAAHKDM4EPKMACHE
SCHEMBL4120554 0.86 GPR119 (0.40) GPR119FAAHKDM4EPKMACHE
SCHEMBL13597345 0.86 GPR119 (0.40) GPR119FAAHKDM4EPKMACHE

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 3 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
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 TGFBR1 1008/4885GPR119 122/4885ADORA2A 1272/4885

“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.