SCHEMBL3763231

SCHEMBL3763231

O=C(O)N1CCC(c2nc(-c3ccccc3)cs2)CC1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FAAH O00519 8/20 0.61
L3MBTL1 Q9Y468 1/20 0.52
HSD11B1 P28845 1/20 0.49
HPGDS O60760 1/20 0.49
SPR P35270 2/20 0.49
CPT1A P50416 1/20 0.48
TRPV1 Q8NER1 1/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SCN9A Q15858 1/20 0.47

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
SCHEMBL18711879 0.90 FAAH (0.59) FAAHL3MBTL1HSD11B1HPGDSSPR
SCHEMBL2358755 0.89 HPGDS (0.66) FAAHL3MBTL1HPGDSSPRCPT1A
SCHEMBL25168713 0.88 FAAH (0.51) FAAHL3MBTL1HSD11B1SPRTRPV1
SCHEMBL3766121 0.88 TRPV1 (0.53) FAAHL3MBTL1HSD11B1TRPV1ALDH1A1
SCHEMBL3774063 0.87 ALDH1A1 (0.49) FAAHHPGDSTRPV1ALDH1A1SMN1; SMN2
SCHEMBL18701751 0.86 FAAH (0.56) FAAHL3MBTL1HSD11B1HPGDSSPR
SCHEMBL25167080 0.84 NPC1 (0.55) FAAHALDH1A1SMN1; SMN2
SCHEMBL3770630 0.84 NPC1 (0.52) FAAHL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL1653297 0.83 USP30 (0.59) FAAHHPGDS
SCHEMBL25168799 0.81 FAAH (0.49) FAAHHPGDSCPT1A

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
EP-2308869-B1 AZOLE COMPOUND ASTELLAS PHARMA INC (JP) 2012-09-19 EP disclosed
US-7851473-B2 Amide compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-14 US disclosed
US-20080312226-A1 Amide Compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-18 US disclosed
EP-1813606-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-08-01 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-20080312226-A1 Amide Compound FAAH, FAAH2, CNR2 FAAH 1/4885L3MBTL1 2773/4885HSD11B1 1455/4885

“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.