SCHEMBL16715230

SCHEMBL16715230

CSSCC[C@H](N)C(=O)O[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc21

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MARS1 P56192 4/20 0.63
▸ ADORA1 P30542 2/20 0.59
▸ RNMT O43148 1/20 0.56
▸ DOT1L Q8TEK3 4/20 0.55
▸ ADORA3 P0DMS8 3/20 0.55
▸ CARM1 Q86X55 2/20 0.55
▸ EHMT2 Q96KQ7 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ EZH2 Q15910 2/20 0.55
▸ NNMT P40261 2/20 0.55
▸ TRDMT1 O14717 1/20 0.55
▸ PRMT5 O14744 1/20 0.55
▸ SUV39H1 O43463 1/20 0.55
▸ PRMT3 O60678 1/20 0.55
▸ INMT O95050 1/20 0.55
▸ NSD2 O96028 1/20 0.55
▸ PNMT P11086 1/20 0.55
▸ DNMT1 P26358 1/20 0.55
▸ HNMT P50135 1/20 0.55
▸ WDR5 P61964 1/20 0.55

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
SCHEMBL16715228 1.00 MARS1 (0.63) MARS1ADORA1RNMTDOT1LADORA3
SCHEMBL16715226 1.00 MARS1 (0.63) MARS1ADORA1RNMTDOT1LADORA3
SCHEMBL16715233 0.94 MARS1 (0.72) MARS1ADORA1RNMTDOT1LADORA3
SCHEMBL16715231 0.94 MARS1 (0.72) MARS1ADORA1RNMTDOT1LADORA3
SCHEMBL16715232 0.94 MARS1 (0.72) MARS1ADORA1RNMTDOT1LADORA3
SCHEMBL16715229 0.94 MARS1 (0.72) MARS1ADORA1RNMTDOT1LADORA3
SCHEMBL16715156 0.93 ADORA1 (0.61) MARS1ADORA1RNMTDOT1LADORA3
SCHEMBL16715152 0.93 ADORA1 (0.61) MARS1ADORA1RNMTDOT1LADORA3
SCHEMBL16715157 0.93 ADORA1 (0.61) MARS1ADORA1RNMTDOT1LADORA3
SCHEMBL16715166 0.87 ADORA1 (0.64) MARS1ADORA1RNMTDOT1LADORA3

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 MARS1 17/4885ADORA1 4442/4885RNMT 31/4885

“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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