SCHEMBL4182920

SCHEMBL4182920

COC(=O)COc1cc(Br)c(OCC(N)=S)cc1C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
HTT P42858 1/20 0.41
POLB P06746 2/20 0.41
GALR3 O60755 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HDAC6 Q9UBN7 1/20 0.37
GAA P10253 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL4182959 0.81 LMNA (0.42) LMNAHTTPOLBGALR3MAPT
SCHEMBL4180979 0.79 LMNA (0.47) LMNAHTTPOLBGALR3MAPT
SCHEMBL4181344 0.78 PPARD (0.49) HTTPOLBALDH1A1KDM4EKMT2A
SCHEMBL4179912 0.76 POLB (0.42) LMNAHTTPOLBGALR3MAPT
SCHEMBL24091309 0.74 LMNA (0.46) LMNAHTTPOLBGALR3MAPT
SCHEMBL4185294 0.73 LMNA (0.51) LMNAHTTPOLBMAPTSMN1; SMN2
SCHEMBL4183137 0.72 LMNA (0.50) LMNAHTTPOLBMAPTSMN1; SMN2
SCHEMBL4182940 0.71 PTGDR2 (0.45) LMNAHTTKMT2ATSHR
SCHEMBL1948781 0.71 SMN1; SMN2 (0.58) LMNAHTTPOLBSMN1; SMN2ALDH1A1
SCHEMBL18791371 0.71 GAA (0.51) LMNAHTTPOLBSMN1; SMN2ALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090192203-A1 COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS IRM LLC (BM) 2009-07-30 US disclosed
US-20090192203-A1 COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS IRM LLC (BM) 2009-07-30 US disclosed
US-20090192203-A1 COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS IRM LLC (BM) 2009-07-30 US disclosed
EP-1945620-A2 COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS IRM LLC (BM) 2008-07-23 EP disclosed
WO-2007056366-A2 COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS IRM LLC (BM) 2007-05-18 WO 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-20090192203-A1 COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS PPARG, PPARA, PPARD LMNA 1383/4885HTT 1136/4885POLB 950/4885

“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.