SCHEMBL4124706

SCHEMBL4124706

N#Cc1ccccc1COc1ccc(CO)c2onc(CCC3CCN(C(=O)O)CC3)c12

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 5/20 0.37
FFAR1 O14842 1/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.34
ALOX15 P16050 1/20 0.34
MET P08581 2/20 0.34
SGMS2 Q8NHU3 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.33
BCHE P06276 1/20 0.33
ALKBH1 Q13686 1/20 0.33
XDH P47989 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL4136385 0.90 GPR119 (0.40)
SCHEMBL4122109 0.88 GRIN2B (0.39) ACHEKMT2AALDH1A1MEN1NPC1
SCHEMBL4114849 0.87 ACHE (0.40) ACHEFFAR1KMT2AALDH1A1MEN1
SCHEMBL4124708 0.86 ACHE (0.38) ACHEALDH1A1ALOX15
Dimethylamine SCHEMBL4122380 0.83 ACHE (0.41) ACHEALDH1A1ALOX15BCHE
SCHEMBL4122121 0.82 ACHE (0.39) ACHEKMT2AMEN1NPC1RAB9A
SCHEMBL4122375 0.82 ACHE (0.40) ACHEALDH1A1ALOX15TRPM8BCHE
SCHEMBL4124713 0.81 ACHE (0.40) ACHEBCHENPC1RAB9A
SCHEMBL4121012 0.77 GPR119 (0.39) ACHEBCHE
SCHEMBL4136388 0.77 GPR119 (0.44)

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 2 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
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 ACHE 3716/4885FFAR1 158/4885KMT2A 1211/4885

“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.