SCHEMBL3548044

SCHEMBL3548044

CC(C)(C)OC(=O)C1CCC(c2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
ALDH1A1 P00352 4/20 0.45
LMNA P02545 1/20 0.45
NAMPT P43490 1/20 0.43
SLC18A3 Q16572 1/20 0.43
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 1/20 0.39
PDE5A O76074 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
FAAH O00519 1/20 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
SCHEMBL3548042 1.00 MAPT (0.46) MAPTALDH1A1LMNANAMPTSLC18A3
SCHEMBL3543089 0.85 MAPT (0.63) MAPTALDH1A1NAMPTSLC18A3KMT2A
SCHEMBL3543093 0.85 MAPT (0.63) MAPTALDH1A1NAMPTSLC18A3KMT2A
SCHEMBL3296952 0.81 SMN1; SMN2 (0.55) MAPTALDH1A1NAMPTSLC18A3KMT2A
SCHEMBL3296949 0.81 SMN1; SMN2 (0.55) MAPTALDH1A1NAMPTSLC18A3KMT2A
SCHEMBL3302195 0.81 SMN1; SMN2 (0.55) MAPTALDH1A1NAMPTSLC18A3KMT2A
SCHEMBL3547219 0.80 NPC1 (0.40) MAPTALDH1A1LMNANAMPTSLC18A3
SCHEMBL3547216 0.80 NPC1 (0.40) MAPTALDH1A1LMNANAMPTSLC18A3
SCHEMBL20246540 0.80 RAB9A (0.40) MAPTALDH1A1LMNANAMPTSMN1; SMN2
SCHEMBL4894965 0.80 POLB (0.56) MAPTALDH1A1LMNAKMT2AMEN1

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-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2010-12-16 US disclosed
US-7795283-B2 Oxadiazole derivative as DGAT inhibitors ASTRAZENECA AB (SE) 2010-09-14 US disclosed
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors ASTRAZENECA AB (SE) 2008-04-24 US 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 (2 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-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS DGAT1, DGAT2, GPR119 MAPT 2115/4885ALDH1A1 314/4885LMNA 3296/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 MAPT 1986/4885ALDH1A1 303/4885LMNA 3477/4885

“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.