SCHEMBL16715174

SCHEMBL16715174

CC(C)C[C@@H](N)C(=O)OC1C(O)C(CO)OC1n1cnc2c(N)ncnc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 2/20 0.64
▸ ADORA3 P0DMS8 3/20 0.61
▸ DOT1L Q8TEK3 3/20 0.61
▸ DPP4 P27487 1/20 0.61
▸ MEN1 O00255 1/20 0.61
▸ SLC28A1 O00337 1/20 0.61
▸ MAP3K7 O43318 1/20 0.61
▸ SLC28A2 O43868 1/20 0.61
▸ GAPDH P04406 1/20 0.61
▸ MAPK1 P28482 1/20 0.61
▸ ADORA2A P29274 1/20 0.61
▸ ADORA2B P29275 1/20 0.61
▸ STAT6 P42226 1/20 0.61
▸ PI4KA P42356 1/20 0.61
▸ KMT2A Q03164 1/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.61
▸ PI4K2B Q8TCG2 1/20 0.61
▸ SLC29A1 Q99808 1/20 0.61
▸ PI4K2A Q9BTU6 1/20 0.61
▸ SLC28A3 Q9HAS3 1/20 0.61

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
SCHEMBL16715179 1.00 ADORA1 (0.64) ADORA1ADORA3DOT1LDPP4MEN1
SCHEMBL16715171 1.00 ADORA1 (0.64) ADORA1ADORA3DOT1LDPP4MEN1
SCHEMBL16715166 1.00 ADORA1 (0.64) ADORA1ADORA3DOT1LDPP4MEN1
SCHEMBL10585758 0.91 ADORA1 (0.68) ADORA1ADORA3DOT1LDPP4MEN1
SCHEMBL16715117 0.89 ADORA1 (0.59) ADORA1ADORA3DOT1LDPP4MEN1
SCHEMBL16715129 0.89 ADORA1 (0.59) ADORA1ADORA3DOT1LDPP4MEN1
SCHEMBL16715125 0.89 ADORA1 (0.59) ADORA1ADORA3DOT1LDPP4MEN1
SCHEMBL16715156 0.89 ADORA1 (0.61) ADORA1ADORA3DOT1LDPP4MEN1
SCHEMBL16715157 0.89 ADORA1 (0.61) ADORA1ADORA3DOT1LDPP4MEN1
SCHEMBL16715152 0.89 ADORA1 (0.61) ADORA1ADORA3DOT1LDPP4MEN1

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-9376700-B2 Methods of modifying N-termini of a peptide or protein using transferases THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2016-06-28 — — US disclosed
US-20150140605-A1 ONE STEP N-TERMINAL TAGGING OF PROTEINS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2015-05-21 — — 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-20150140605-A1 ONE STEP N-TERMINAL TAGGING OF PROTEINS TRMT1, RNGTT, NSUN3 ADORA1 4442/4885ADORA3 4406/4885DOT1L 564/4885

“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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