SCHEMBL7264355

SCHEMBL7264355

O=C(Nc1n[c]nc2nc[nH]c12)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 8/20 0.67
NT5C2 P49902 2/20 0.58
NT5E P21589 1/20 0.56
STAT3 P40763 3/20 0.48
CREBBP Q92793 1/20 0.48
BTK Q06187 1/20 0.44
TOP2A P11388 1/20 0.43
AURKA O14965 1/20 0.42
HDAC1 Q13547 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL5857624 0.84 BRD4 (0.71) BRD4NT5C2CREBBPAURKA
SCHEMBL29514799 0.81 BRD4 (1.00) BRD4NT5C2NT5ECREBBPBTK
SCHEMBL23124 0.81 BRD4 (1.00) BRD4NT5C2NT5ECREBBPBTK
SCHEMBL8381776 0.80 BRD4 (0.97) BRD4NT5C2NT5ECREBBPBTK
SCHEMBL7717445 0.80 BRD4 (0.51) BRD4NT5C2NT5EHTT
SCHEMBL2346676 0.79 MKNK1 (0.41) BRD4NT5C2NT5ETOP2A
SCHEMBL8121393 0.78 STAT3 (0.69) BRD4NT5C2NT5ESTAT3CREBBP
SCHEMBL5694052 0.78 BRD4 (0.67) BRD4NT5C2NT5ESTAT3CREBBP
SCHEMBL5860314 0.78 POLB (0.45) BRD4HTT
SCHEMBL5858886 0.78 BRD4 (0.42) BRD4NT5C2NT5ECREBBPTOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11597745-B2 β-modified phosphoric acid compound precursor, β-modified phosphoric acid compound, reaction inhibitor and medicine containing the same, and method for inhibiting reaction JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2023-03-07 US claimed
US-6649750-B1 Nucleoside linked to a support through heterocyclic base and amide bond; deblocking/deprotecting; capping/oxidizing; purity; reduced levels of byproducts containing abasic sites ISIS PHARMACEUTICALS, INC. 2003-11-18 US claimed
US-5952478-A Intermediates for dinucleotide and oligonucleotide analogues NOVARTIS FINANCE CORPORATION (US) 1999-09-14 US claimed
EP-0778843-A1 INTERMEDIATES FOR DINUCLEOTIDE AND OLIGONUCLEOTIDE ANALOGUES Novartis AG (CH) 1997-06-18 EP claimed
US-5508270-A Nucleoside phosphinate compounds and compositions CIBA-GEIGY CORPORATION (US) 1996-04-16 US claimed
WO-1996008503-A1 INTERMEDIATES FOR DINUCLEOTIDE AND OLIGONUCLEOTIDE ANALOGUES NOVARTIS AG (CH) 1996-03-21 WO claimed
EP-0614906-A1 Mononucleotide analogues and intermediates therefor CIBA-GEIGY AG (CH) 1994-09-14 EP claimed
US-11597745-B2 β-modified phosphoric acid compound precursor, β-modified phosphoric acid compound, reaction inhibitor and medicine containing the same, and method for inhibiting reaction JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2023-03-07 US disclosed
US-6380378-B1 BIOSYNTHESIS TOAGOSEI COMPANY, LTD. (JP) 2002-04-30 US disclosed
US-5952478-A Intermediates for dinucleotide and oligonucleotide analogues NOVARTIS FINANCE CORPORATION (US) 1999-09-14 US disclosed
EP-0778843-A1 INTERMEDIATES FOR DINUCLEOTIDE AND OLIGONUCLEOTIDE ANALOGUES Novartis AG (CH) 1997-06-18 EP disclosed
US-5508270-A Nucleoside phosphinate compounds and compositions CIBA-GEIGY CORPORATION (US) 1996-04-16 US disclosed
WO-1996008503-A1 INTERMEDIATES FOR DINUCLEOTIDE AND OLIGONUCLEOTIDE ANALOGUES NOVARTIS AG (CH) 1996-03-21 WO disclosed
EP-0614906-A1 Mononucleotide analogues and intermediates therefor CIBA-GEIGY AG (CH) 1994-09-14 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-11597745-B2 β-modified phosphoric acid compound precursor, β-modified phosphoric acid compound, reaction inhibitor and medicine containing the same, and method for inhibiting reaction PPM1A, PPM1G, PPM1F BRD4 1684/4885NT5C2 3957/4885NT5E 4476/4885

“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.