SCHEMBL13009586

SCHEMBL13009586

CCOC(=O)/C=C1\CC[C@@H](c2ccc(Br)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 3/20 0.41
HTT P42858 3/20 0.41
MAPT P10636 3/20 0.39
MAPK1 P28482 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
S1PR4 O95977 1/20 0.39
S1PR1 P21453 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TSHR P16473 1/20 0.37
ALDH1A1 P00352 2/20 0.37
GPBAR1 Q8TDU6 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
GAA P10253 1/20 0.34
MAP1LC3B Q9GZQ8 1/20 0.34
FPR2 P25090 1/20 0.34
BRD4 O60885 1/20 0.34

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
SCHEMBL13169133 1.00 ESR2 (0.67) ESR2JAK2JAK1LMNAHTT
SCHEMBL13009594 1.00 ESR2 (0.67) ESR2JAK2JAK1LMNAHTT
SCHEMBL13169140 0.87 ESR2 (0.67) ESR2JAK2JAK1LMNAHTT
SCHEMBL13009596 0.87 ESR2 (0.67) ESR2JAK2JAK1LMNAHTT
SCHEMBL13009589 0.87 ESR2 (0.67) ESR2JAK2JAK1LMNAHTT
SCHEMBL18257860 0.81 ESR2 (0.82) ESR2JAK2JAK1MAPTALDH1A1
SCHEMBL10188554 0.80 ESR2 (1.00) ESR2JAK2JAK1TSHRALDH1A1
SCHEMBL3547323 0.79 BRD4 (0.40) ESR2LMNAHTTMAPTALDH1A1
SCHEMBL3547397 0.79 BRD4 (0.40) ESR2LMNAHTTMAPTALDH1A1
SCHEMBL3547327 0.79 BRD4 (0.40) ESR2LMNAHTTMAPTALDH1A1

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 6 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
US-7795283-B2 Oxadiazole derivative as DGAT inhibitors ASTRAZENECA AB (SE) 2010-09-14 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
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 ESR2 2111/4885JAK2 2560/4885JAK1 3963/4885
US-20080096874-A1 Oxadiazole Derivative as Dgat Inhibitors DGAT1, DGAT2, GPR119 ESR2 2062/4885JAK2 2557/4885JAK1 3903/4885

“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.