SCHEMBL10178065

SCHEMBL10178065

CC(C)C(OCc1cn([C@H]2C[C@@H](O)[C@@H](CO)O2)c(=O)nc1N)c1ccc(C#CCNC(=O)C(F)(F)F)cc1[N+](=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 9/20 0.41
DNMT3B Q9UBC3 4/20 0.39
FPR2 P25090 2/20 0.34
ADRB1 P08588 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
SCHEMBL13475068 0.93 DNMT1 (0.41) DNMT1DNMT3BFPR2ADRB1
SCHEMBL16731433 0.92 DNMT1 (0.40) DNMT1DNMT3BFPR2ADRB1
SCHEMBL2065719 0.90 P2RY2 (0.36) DNMT1
SCHEMBL10178137 0.89 CA2 (0.36) DNMT1DNMT3BFPR2
SCHEMBL10178240 0.88 LMNA (0.31) DNMT1
SCHEMBL2065887 0.88 TK1 (0.42)
SCHEMBL2065883 0.88 TK1 (0.42)
SCHEMBL12762684 0.88 TK1 (0.42)
SCHEMBL14778032 0.88 TK1 (0.42)
SCHEMBL12570204 0.88 TK1 (0.42)

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-8148503-B2 Nucleotides and nucleosides and methods for their use in DNA sequencing LASERGEN, INC. (US) 2012-04-03 US disclosed
US-20100041041-A1 NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING AGILENT TECHNOLOGIES, INC. 2010-02-18 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-20100041041-A1 NUCLEOTIDES AND NUCLEOSIDES AND METHODS FOR THEIR USE IN DNA SEQUENCING UNG, NT5C2, NT5E DNMT1 55/4885DNMT3B 69/4885FPR2 2472/4885

“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.