SCHEMBL3770534

SCHEMBL3770534

CC(C)(C)OC(=O)N1CCN(c2nc(-c3cccc(C#N)c3)cs2)CC1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.53
SPR P35270 1/20 0.50
MAPT P10636 10/20 0.49
MAPK1 P28482 7/20 0.49
LMNA P02545 8/20 0.49
ALDH1A1 P00352 7/20 0.49
HTT P42858 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
TP53 P04637 3/20 0.49
HSD17B10 Q99714 3/20 0.49
TSHR P16473 2/20 0.49
GAA P10253 2/20 0.49
RAB9A P51151 3/20 0.48
NPC1 O15118 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
USP30 Q70CQ3 1/20 0.47
EGLN2 Q96KS0 1/20 0.45

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
SCHEMBL18702280 0.87 SPR (0.52) FAAHSPRMAPTMAPK1LMNA
SCHEMBL3767461 0.86 MAPT (0.54) FAAHMAPTMAPK1LMNAALDH1A1
SCHEMBL18711347 0.86 SPR (0.54) FAAHSPRMAPTMAPK1LMNA
SCHEMBL3764614 0.85 FAAH (0.58) FAAHSPRMAPTMAPK1LMNA
SCHEMBL3778538 0.85 SMN1; SMN2 (0.59) SPRMAPTMAPK1LMNAALDH1A1
SCHEMBL3765898 0.85 RAB9A (0.55) FAAHSPRMAPTMAPK1LMNA
SCHEMBL3765754 0.85 RAB9A (0.66) FAAHMAPTMAPK1LMNAALDH1A1
SCHEMBL3770715 0.84 MAPT (0.68) MAPTMAPK1LMNAALDH1A1HTT
SCHEMBL3772450 0.83 AR (0.61) FAAHSPRMAPTMAPK1LMNA
SCHEMBL27691357 0.83 MAPT (0.50) MAPTMAPK1LMNAALDH1A1HTT

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
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
CN-101103007-A Amide compound TAKEDA PHARMACEUTICAL (JP) 2008-01-09 CN 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 1/4885SPR 1521/4885MAPT 3805/4885

“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.