SCHEMBL4122097

SCHEMBL4122097

CN(C)Cc1c(-c2ccccn2)ccc2c(CCC3CCN(C(=O)OC(C)(C)C)CC3)noc12

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 11/20 0.42
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
USP30 Q70CQ3 1/20 0.39
FAAH O00519 1/20 0.39
MMP13 P45452 1/20 0.38
ACHE P22303 1/20 0.38
CSF1R P07333 1/20 0.37
KDR P35968 1/20 0.37
SGMS1 Q86VZ5 1/20 0.37
SGMS2 Q8NHU3 1/20 0.37

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
SCHEMBL4120349 0.92 GPR119 (0.43) GPR119KDM4EPKMUSP30FAAH
SCHEMBL4121102 0.90 ACHE (0.40) ACHE
SCHEMBL13596326 0.89 KDM4E (0.42) GPR119KDM4EPKMUSP30FAAH
SCHEMBL4112768 0.89 GPR119 (0.40) GPR119KDM4EPKMUSP30FAAH
SCHEMBL4115825 0.87 GPR119 (0.41) GPR119KDM4EPKMFAAHACHE
Dimethylamine SCHEMBL4122103 0.87 GPR119 (0.42) GPR119KDM4EPKMUSP30FAAH
SCHEMBL4129621 0.86 GPR119 (0.47) GPR119USP30FAAH
SCHEMBL4120522 0.86 GPR119 (0.46) GPR119FAAHSGMS2
SCHEMBL4122124 0.85 GPR119 (0.40) GPR119KDM4EPKMFAAHACHE
SCHEMBL4126785 0.85 GPR119 (0.44) GPR119KDM4EPKMFAAHACHE

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 5 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
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 122/4885KDM4E 3136/4885PKM 2715/4885

“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.