SCHEMBL4119583

SCHEMBL4119583

CC=Cc1c(NC(C)=O)ccc2c(CCC3CCN(C(=O)OC(C)(C)C)CC3)noc12

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 1/20 0.42
BCHE P06276 2/20 0.41
ACHE P22303 2/20 0.41
GPR119 Q8TDV5 11/20 0.40
KDM4E B2RXH2 1/20 0.38
PKM P14618 1/20 0.38
FAAH O00519 1/20 0.37
GLS O94925 1/20 0.36
CETP P11597 1/20 0.36
PTPN2 P17706 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPN6 P29350 1/20 0.36

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
SCHEMBL4121315 1.00 TGFBR1 (0.42) TGFBR1BCHEACHEGPR119KDM4E
SCHEMBL4119577 1.00 TGFBR1 (0.42) TGFBR1BCHEACHEGPR119KDM4E
SCHEMBL4120800 0.87 GPR119 (0.42) ACHEGPR119KDM4EPKMFAAH
SCHEMBL4128212 0.87 GPR119 (0.42) ACHEGPR119KDM4EPKMFAAH
SCHEMBL4120804 0.87 GPR119 (0.42) ACHEGPR119KDM4EPKMFAAH
SCHEMBL4120922 0.86 GPR119 (0.42) ACHEGPR119KDM4EPKMFAAH
SCHEMBL4126984 0.86 GPR119 (0.42) ACHEGPR119KDM4EPKMFAAH
SCHEMBL4112192 0.86 GPR119 (0.42) ACHEGPR119KDM4EPKMFAAH
SCHEMBL13597372 0.86 ACHE (0.45) BCHEACHE
SCHEMBL4125889 0.84 GPR119 (0.40) TGFBR1GPR119FAAH

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 1008/4885BCHE 2215/4885ACHE 3716/4885

“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.