SCHEMBL5462136

SCHEMBL5462136

COc1c[c]cc(Br)c1OCC(=O)NCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.61
ALDH1A1 P00352 3/20 0.61
PKM P14618 2/20 0.61
KMT2A Q03164 5/20 0.58
MEN1 O00255 2/20 0.58
SMN1; SMN2 Q16637 4/20 0.56
GAA P10253 1/20 0.53
LMNA P02545 3/20 0.52
POLB P06746 1/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49
PDE4D Q08499 1/20 0.48
NSD2 O96028 1/20 0.48
UBE2N P61088 1/20 0.48

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
SCHEMBL14363098 0.81 HPGD (0.70) HPGDALDH1A1PKMKMT2AMEN1
SCHEMBL9263271 0.77 SMN1; SMN2 (0.68) HPGDALDH1A1PKMKMT2AMEN1
SCHEMBL29954842 0.75 KMT2A (0.59) HPGDALDH1A1PKMKMT2AMEN1
SCHEMBL9267938 0.73 HCRTR2 (0.65) HPGDPKMKMT2AMEN1SMN1; SMN2
SCHEMBL24590651 0.72 SMN1; SMN2 (1.00) HPGDALDH1A1KMT2ASMN1; SMN2LMNA
SCHEMBL2719871 0.71 KMT2A (0.67) HPGDALDH1A1PKMKMT2AMEN1
SCHEMBL5272168 0.70 KMT2A (1.00) HPGDALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL9271168 0.69 KMT2A (0.73) HPGDALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL29957873 0.69 ALDH1A1 (0.72) HPGDALDH1A1PKMKMT2AMEN1
SCHEMBL1298892 0.68 MITF (0.39) HPGDALDH1A1KMT2AMEN1SMN1; SMN2

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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 US claimed
EP-1666469-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Institute of Medicinal Molecular Design, Inc. (JP) 2006-06-07 EP claimed
US-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 US disclosed
EP-1666469-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Institute of Medicinal Molecular Design, Inc. (JP) 2006-06-07 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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 HPGD 556/4885ALDH1A1 1861/4885PKM 2050/4885

“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.