SCHEMBL13009596

SCHEMBL13009596

CCOC(=O)/C=C1\CC[C@H](c2ccc(N)cc2)C1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.67
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
LMNA P02545 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAOA P21397 1/20 0.40
PPIB P23284 2/20 0.35
PPID Q08752 2/20 0.35
PPIA P62937 1/20 0.35
PPIG Q13427 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
RECQL P46063 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPT P10636 2/20 0.32
PRKCZ Q05513 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL13009589 1.00 ESR2 (0.67) ESR2JAK2JAK1LMNACYP1A2
SCHEMBL13169140 1.00 ESR2 (0.67) ESR2JAK2JAK1LMNACYP1A2
SCHEMBL13169133 0.87 ESR2 (0.67) ESR2JAK2JAK1LMNASMN1; SMN2
SCHEMBL13009586 0.87 ESR2 (0.67) ESR2JAK2JAK1LMNASMN1; SMN2
SCHEMBL13009594 0.87 ESR2 (0.67) ESR2JAK2JAK1LMNASMN1; SMN2
SCHEMBL18257860 0.81 ESR2 (0.82) ESR2JAK2JAK1SMN1; SMN2RECQL
SCHEMBL10188554 0.80 ESR2 (1.00) ESR2JAK2JAK1CYP3A4SMN1; SMN2
SCHEMBL3547927 0.79 ESR2 (0.39) ESR2LMNAMAPTNPC1GAA
SCHEMBL3544911 0.79 ESR2 (0.39) ESR2LMNAMAPTNPC1GAA
SCHEMBL3547925 0.79 ESR2 (0.39) ESR2LMNAMAPTNPC1GAA

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-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2010-12-16 US disclosed
US-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2010-12-16 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 (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-20100317653-A1 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS DGAT1, DGAT2, GPR119 ESR2 2111/4885JAK2 2560/4885JAK1 3963/4885

“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.