SCHEMBL733738

SCHEMBL733738

CC(C)(C)c1ccc(OCC(=O)Nc2nc3c(ncn3[C@H]3C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COC(=O)c4ccccc4C(=O)Oc4ccccc4C#N)O3)c(=O)[nH]2)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
TAS1R3 Q7RTX0 2/20 0.34
TAS1R1 Q7RTX1 2/20 0.34
POLA1 P09884 1/20 0.34
P2RY1 P47900 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
PKM P14618 1/20 0.32
TSHR P16473 1/20 0.32
TYMP P19971 1/20 0.31
ALDH1A1 P00352 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL735108 0.92 POLA1 (0.41) KDM4ETAS1R3TAS1R1POLA1HCAR2
SCHEMBL732905 0.90 KDM4E (0.43) KDM4ETAS1R3TAS1R1POLA1P2RY1
SCHEMBL733920 0.86 KDM4E (0.39) KDM4ETAS1R3TAS1R1POLA1
SCHEMBL734168 0.84 KDM4E (0.46) KDM4ETAS1R3TAS1R1POLA1P2RY1
SCHEMBL733837 0.83 KDM4E (0.53) KDM4ETAS1R3TAS1R1POLA1P2RY1
SCHEMBL3024229 0.78 KDM4E (0.45) KDM4ETAS1R3TAS1R1POLA1P2RY1
SCHEMBL735044 0.76 RNASE1 (0.47)
SCHEMBL734937 0.74 POLA1 (0.56) KDM4ETAS1R3TAS1R1POLA1TYMP
SCHEMBL31572675 0.72 KDM4E (0.41) KDM4ETAS1R3TAS1R1POLA1P2RY1
SCHEMBL31098030 0.72 KDM4E (0.57) KDM4ETAS1R3TAS1R1POLA1P2RY1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138330-B2 Solid phase synthesis via deblocking immobilized nucleoside, then coupling acyl protected nucleoside phosphoramidite SIGMA-ALDRICH CO. LLC (US) 2012-03-20 US disclosed
US-20080064867-A1 PROCESS FOR THE SYNTHESIS OF OLIGONUCLEOTIDES SIGMA ALDRICH COMPANY (US) 2008-03-13 US 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-20080064867-A1 PROCESS FOR THE SYNTHESIS OF OLIGONUCLEOTIDES RNGTT, DUT, ADAR KDM4E 1717/4885TAS1R3 4448/4885TAS1R1 4365/4885

“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.