SCHEMBL2030636

SCHEMBL2030636

CCOP(=O)(O)OCCC#N

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.38
TSHR P16473 2/20 0.38
PPARD Q03181 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
TP53 P04637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
BTN3A1 O00481 1/20 0.32
LPAR3 Q9UBY5 3/20 0.31
LPAR1 Q92633 2/20 0.31
LPAR2 Q9HBW0 2/20 0.31

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
SCHEMBL497349 0.89 P2RY14 (0.34) TSHRTDP1ALDH1A1BTN3A1
SCHEMBL2032723 0.88 LPAR3 (0.35) ACHETSHRMEN1KMT2ABTN3A1
SCHEMBL21902088 0.85 CYP3A4 (0.47) TSHRLPAR3LPAR1LPAR2
Diethyl Hydrogen Phosphate SCHEMBL29712368 0.83 TSHR (0.44) ACHETSHRPPARDMEN1KMT2A
Diethyl Hydrogen Phosphate SCHEMBL27258211 0.83 TSHR (0.48) ACHETSHRPPARDKMT2ATP53
SCHEMBL18291794 0.82 BTN3A1 (0.32) BTN3A1
SCHEMBL16579313 0.82 P2RY14 (0.32)
Diethyl Hydrogen Phosphate SCHEMBL5605297 0.81 TSHR (0.46) ACHETSHRPPARDMEN1KMT2A
SCHEMBL12914746 0.80 TSHR (0.48) TSHRPPARDTP53TDP1CA12
Diethyl Hydrogen Phosphate SCHEMBL27335740 0.80 TSHR (0.53) ACHETSHRPPARDTP53TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365607-B1 Synthesis of deuterated ribo nucleosides, N-protected phosphoramidites, and oligonucleotides ASED, LLC (US) 2016-06-14 US claimed
US-8541569-B2 Phosphoramidites for synthetic RNA in the reverse direction, efficient RNA synthesis and convenient introduction of 3'-end ligands, chromophores and modifications of synthetic RNA CHEMGENES CORPORATION (US) 2013-09-24 US claimed
US-20110137010-A1 PHOSPHORAMIDITES FOR SYNTHETIC RNA IN THE REVERSE DIRECTION, EFFICIENT RNA SYNTHESIS AND CONVENIENT INTRODUCTION OF 3'-END LIGANDS, CHROMOPHORES AND MODIFICATIONS OF SYNTHETIC RNA CHEMGENES CORPORATION (US) 2011-06-09 US claimed
US-9365607-B1 Synthesis of deuterated ribo nucleosides, N-protected phosphoramidites, and oligonucleotides ASED, LLC (US) 2016-06-14 US disclosed
US-8541569-B2 Phosphoramidites for synthetic RNA in the reverse direction, efficient RNA synthesis and convenient introduction of 3'-end ligands, chromophores and modifications of synthetic RNA CHEMGENES CORPORATION (US) 2013-09-24 US disclosed
US-20110137010-A1 PHOSPHORAMIDITES FOR SYNTHETIC RNA IN THE REVERSE DIRECTION, EFFICIENT RNA SYNTHESIS AND CONVENIENT INTRODUCTION OF 3'-END LIGANDS, CHROMOPHORES AND MODIFICATIONS OF SYNTHETIC RNA CHEMGENES CORPORATION (US) 2011-06-09 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-20110137010-A1 PHOSPHORAMIDITES FOR SYNTHETIC RNA IN THE REVERSE DIRECTION, EFFICIENT RNA SYNTHESIS AND CONVENIENT INTRODUCTION OF 3'-END LIGANDS, CHROMOPHORES AND MODIFICATIONS OF SYNTHETIC RNA NSUN3, RNGTT, NOP2 ACHE 3830/4885TSHR 1472/4885PPARD 1810/4885

“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.