SCHEMBL4131675

SCHEMBL4131675

CN(C)Cc1c(Cc2ccccc2)ccc2c(CCC3CCN(C(=O)OC(C)(C)C)CC3)noc12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.46
ACHE P22303 10/20 0.44
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
BCHE P06276 3/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
GAA P10253 1/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
STS P08842 1/20 0.40
P2RX7 Q99572 2/20 0.39

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
SCHEMBL4125322 0.92 ACHE (0.45) GPR119ACHEBCHEKDM4EPKM
SCHEMBL4120426 0.90 ACHE (0.46) ACHEBCHE
SCHEMBL4119917 0.87 ACHE (0.45) GPR119ACHEJAK2JAK1BCHE
SCHEMBL13596326 0.87 KDM4E (0.42) GPR119ACHEJAK2JAK1BCHE
Dimethylamine SCHEMBL4131682 0.87 KDM4E (0.46) GPR119ACHEBCHEKDM4EPKM
SCHEMBL4129938 0.87 GPR119 (0.42) GPR119ACHEKDM4EPKM
SCHEMBL4125329 0.87 GPR119 (0.42) GPR119KDM4EPKM
SCHEMBL4128096 0.87 ACHE (0.44) GPR119ACHEJAK2JAK1BCHE
SCHEMBL13596232 0.86 GPR119 (0.40) GPR119ACHEKDM4EPKM
SCHEMBL13597347 0.86 GPR119 (0.43) GPR119KDM4EPKM

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 122/4885ACHE 3716/4885JAK2 1131/4885

“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.