SCHEMBL4121133

SCHEMBL4121133

CN(C)Cc1c(-c2cccs2)ccc2c(CCC3CCN(C(=O)OC(C)(C)C)CC3)noc12

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 12/20 0.43
TGFBR1 P36897 1/20 0.40
GBA1 P04062 1/20 0.39
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
ACHE P22303 1/20 0.36
FAAH O00519 1/20 0.36
LMNA P02545 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
SCHEMBL4128429 0.92 GPR119 (0.42) GPR119TGFBR1GBA1KDM4EPKM
SCHEMBL4124796 0.90 ACHE (0.39) ACHE
SCHEMBL4126897 0.89 GPR119 (0.40) GPR119TGFBR1GBA1KDM4EPKM
SCHEMBL13596326 0.87 KDM4E (0.42) GPR119KDM4EPKMACHEFAAH
Dimethylamine SCHEMBL4121143 0.87 TGFBR1 (0.42) GPR119TGFBR1GBA1KDM4EPKM
SCHEMBL4129621 0.86 GPR119 (0.47) GPR119FAAH
SCHEMBL4133483 0.85 GPR119 (0.38) GPR119ACHEFAAHLMNA
SCHEMBL4126785 0.85 GPR119 (0.44) GPR119TGFBR1KDM4EPKMACHE
SCHEMBL4122097 0.84 GPR119 (0.42) GPR119KDM4EPKMACHEFAAH
SCHEMBL4120522 0.84 GPR119 (0.46) GPR119GBA1FAAH

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 GPR119 122/4885TGFBR1 1008/4885GBA1 1581/4885

“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.