SCHEMBL16489142

SCHEMBL16489142

C#CCO[C@@H]1C[C@H](n2cnc3c(=O)[nH]c(N)nc32)O[C@@H]1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.56
▸ POLB P06746 1/20 0.48
▸ P2RY2 P41231 1/20 0.41
▸ P2RY4 P51582 1/20 0.41
▸ P2RY6 Q15077 1/20 0.41
▸ HINT1 P49773 3/20 0.41
▸ HPRT1 P00492 1/20 0.40
▸ FUT5 Q11128 1/20 0.40
▸ NT5E P21589 1/20 0.39
▸ F2 P00734 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ TOP2A P11388 1/20 0.38
▸ PNP P00491 1/20 0.38
▸ GSK3A P49840 1/20 0.38
▸ RPS6KA3 P51812 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38

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
SCHEMBL21778179 1.00 KDM4E (0.56) KDM4EPOLBP2RY2P2RY4P2RY6
SCHEMBL16844109 0.88 POLB (0.51) KDM4EPOLBP2RY2P2RY4P2RY6
SCHEMBL4578872 0.88 POLB (0.51) KDM4EPOLBP2RY2P2RY4P2RY6
SCHEMBL12570242 0.88 POLB (0.51) KDM4EPOLBP2RY2P2RY4P2RY6
SCHEMBL1514931 0.88 POLB (0.51) KDM4EPOLBP2RY2P2RY4P2RY6
SCHEMBL7613803 0.88 POLB (0.51) KDM4EPOLBP2RY2P2RY4P2RY6
SCHEMBL21538191 0.88 POLB (0.48) KDM4EPOLBP2RY2P2RY4P2RY6
SCHEMBL427928 0.87 POLB (0.48) KDM4EPOLBP2RY2P2RY4P2RY6
SCHEMBL887469 0.87 POLB (0.48) KDM4EPOLBP2RY2P2RY4P2RY6
SCHEMBL427927 0.87 POLB (0.48) KDM4EPOLBP2RY2P2RY4P2RY6

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-9932623-B2 Nucleotide analogs ABBOTT MOLECULAR INC. (US) 2018-04-03 — — US disclosed
US-9932623-B2 Nucleotide analogs ABBOTT MOLECULAR INC. (US) 2018-04-03 — — US disclosed
US-20150050697-A1 NUCLEOTIDE ANALOGS ABBOTT MOLECULAR INC. 2015-02-19 — — US disclosed
US-20150050697-A1 NUCLEOTIDE ANALOGS ABBOTT MOLECULAR INC. 2015-02-19 — — US disclosed
US-20150051113-A1 NUCLEOTIDE ANALOGS ABBOTT MOLECULAR INC. 2015-02-19 — — US disclosed
US-20150051113-A1 NUCLEOTIDE ANALOGS ABBOTT MOLECULAR INC. 2015-02-19 — — 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-20150050697-A1 NUCLEOTIDE ANALOGS NUDT1, NT5C3B, RNGTT KDM4E 4150/4885POLB 32/4885P2RY2 314/4885

“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.

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