SCHEMBL4366632

SCHEMBL4366632

COc1ccc(C(NC[C@H](O)COCc2cccc3ccccc23)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CASR P41180 9/20 0.50
MAPT P10636 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.40
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
PTPN1 P18031 1/20 0.39
MMP9 P14780 1/20 0.39
AKR1B1 P15121 1/20 0.38

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
SCHEMBL4366635 0.86 CASR (0.46) CASRMAPTMEN1KMT2ATDP1
SCHEMBL4366631 0.86 CASR (0.46) CASRMAPTMEN1KMT2ATDP1
SCHEMBL4374351 0.79 CASR (0.52) CASRMAPTMEN1KMT2AADRB2
SCHEMBL4364972 0.78 PTPN1 (0.38) CASRMAPTMEN1KMT2ATDP1
SCHEMBL21792805 0.74 ADRB2 (0.64) CASRTDP1TSHRADRB2ADRB1
SCHEMBL4367357 0.73 KIF11 (0.44) CASRMEN1KMT2A
SCHEMBL2048837 0.71 CTSK (0.36) CASRMEN1KMT2ATSHR
SCHEMBL4367349 0.70 MEN1 (0.58) CASRMEN1KMT2ATDP1
SCHEMBL14383158 0.67 CASR (0.60) CASRADRB2ADRB1ADRB3PTPN1
SCHEMBL12762284 0.67 KCNN4 (0.48) TDP1

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
EP-1908829-B1 OLIGONUCLEOTIDE PROBE NAT INST OF ADVANCED IND SCIEN (JP) 2014-01-08 EP disclosed
US-7491857-B2 Oligonucleotide probe NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2009-02-17 US disclosed
US-20080227968-A1 Oligonucleotide Probe NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2008-09-18 US disclosed
EP-1908829-A1 OLIGONUCLEOTIDE PROBE National Institute of Advanced Industrial Science and Technology (JP) 2008-04-09 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-20080227968-A1 Oligonucleotide Probe APEX1, RNGTT, RNASEH1 CASR 2347/4885MAPT 4572/4885MEN1 1946/4885

“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.