SCHEMBL7124808

SCHEMBL7124808

CN(C)CCNCCOCCO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
TSHR P16473 3/20 0.42
MAPK1 P28482 1/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PRMT3 O60678 1/20 0.36
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
PRMT1 Q99873 1/20 0.36
PRMT8 Q9NR22 1/20 0.36
PAOX Q6QHF9 1/20 0.35
ANPEP P15144 1/20 0.34
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL17919549 0.98 MEN1 (0.44) CYP2C9CYP2C19TSHRMAPK1MEN1
SCHEMBL18160820 0.85 CYP2C9 (0.50) CYP2C9CYP2C19TSHRMAPK1TDP1
SCHEMBL29173976 0.83 TSHR (0.41) CYP2C9CYP2C19TSHRMAPTTDP1
SCHEMBL720627 0.82 TSHR (0.62) CYP2C19TSHRMAPK1MEN1KMT2A
SCHEMBL25379173 0.82 TDP1 (0.50) CYP2C9CYP2C19TSHRMAPK1MEN1
SCHEMBL5932834 0.80 CYP2C9 (0.42) CYP2C9CYP2C19TSHRMAPTTDP1
SCHEMBL21001064 0.80 KDM4E (0.37) CYP2C19TSHRMAPK1MEN1KMT2A
SCHEMBL7077220 0.79 MEN1 (0.65) TSHRMAPK1MEN1KMT2AMAPT
SCHEMBL15965457 0.79 MEN1 (0.65) TSHRMAPK1MEN1KMT2AMAPT
SCHEMBL31584385 0.79 MEN1 (0.65) TSHRMAPK1MEN1KMT2AMAPT

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-20040009938-A1 Methods of enhancing renal uptake of oligonucleotides ISIS PHARMACEUTICAL INC. 2004-01-15 US disclosed
US-6600032-B1 Compound for use in the treatment of viral, protozoan and parasitic infections ISIS PHARMACEUTICALS, INC. 2003-07-29 US disclosed
EP-1102787-A1 2'-O-AMINOETHYLOXYETHYL-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 2001-05-30 EP disclosed
WO-2000008044-A1 2'-O-AMINOETHYLOXYETHYL-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 2000-02-17 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-20040009938-A1 Methods of enhancing renal uptake of oligonucleotides NUDT1, SLC29A2, DUT CYP2C9 3349/4885CYP2C19 3611/4885TSHR 1259/4885

“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.