SCHEMBL4370978

SCHEMBL4370978

COC[C@H](CNC(c1ccccc1)(c1ccccc1)c1ccc(OC)cc1)OC(=O)NCCCCCCO

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
KIF11 P52732 3/20 0.41
GAA P10253 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
POLB P06746 2/20 0.37
SIGMAR1 Q99720 1/20 0.37
NAMPT P43490 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TACR3 P29371 2/20 0.36
KDM4E B2RXH2 2/20 0.36
LMNA P02545 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 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
SCHEMBL4364314 0.88 NPC1 (0.43) NPC1RAB9AKIF11GAATAAR1
SCHEMBL4364972 0.86 PTPN1 (0.38) KDM4EKMT2AMEN1ALDH1A1
SCHEMBL4359150 0.83 NPC1 (0.45) NPC1RAB9AKIF11GAATAAR1
SCHEMBL10309879 0.78 KIF11 (0.45) NPC1RAB9AKIF11POLBSMN1; SMN2
SCHEMBL6302955 0.78 KIF11 (0.45) NPC1RAB9AKIF11POLBSMN1; SMN2
SCHEMBL8053146 0.78 KIF11 (0.45) NPC1RAB9AKIF11POLBSMN1; SMN2
SCHEMBL9439820 0.73 KIF11 (0.47) KIF11POLBSIGMAR1SMN1; SMN2KDM4E
SCHEMBL888258 0.73 KIF11 (0.44) NPC1RAB9AKIF11POLBSMN1; SMN2
SCHEMBL4374351 0.72 CASR (0.52) GAAKMT2AMEN1ALDH1A1
SCHEMBL29142567 0.72 KIF11 (0.39) NPC1RAB9AKIF11POLBSIGMAR1

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 NPC1 3238/4885RAB9A 4788/4885KIF11 3783/4885

“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.