Sugi Predict

Sugi Predict / Compounds / SCHEMBL31175751

SCHEMBL31175751

SCHEMBL31175751

Nc1ncnc2c1ncn2C1O[C@H](COP(=O)(O)O[C@@H]2[C@H](O)[C@@H](COP(=O)(O)OC3[C@H](n4cnc5c(N)ncnc54)O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@H]3O)O[C@H]2n2cnc3c(N)ncnc32)[C@@H](O)[C@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ RNASEL Q05823 7/20 1.00
▸ P2RY1 P47900 3/20 0.83
▸ P2RY2 P41231 2/20 0.83
▸ SRC P12931 1/20 0.83
▸ P2RX1 P51575 1/20 0.83
▸ P2RX3 P56373 1/20 0.83
▸ P2RX4 Q99571 1/20 0.83
▸ P2RX2 Q9UBL9 1/20 0.83
▸ ALDH1A1 P00352 1/20 0.83
▸ SMN1; SMN2 Q16637 1/20 0.83

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
SCHEMBL29770258 1.00 RNASEL (1.00) RNASELP2RY1P2RY2SRCP2RX1
SCHEMBL29520474 1.00 RNASEL (1.00) RNASELP2RY1P2RY2SRCP2RX1
SCHEMBL7997565 0.95 RNASEL (0.90) RNASELP2RY1P2RY2SRCP2RX1
Adenosine Triphosphate SCHEMBL1496267 0.95 P2RY1 (0.93) RNASELP2RY1P2RY2SRCP2RX1
Adenosine Triphosphate SCHEMBL193647 0.95 P2RY1 (0.93) RNASELP2RY1P2RY2SRCP2RX1
Adenosine Triphosphate SCHEMBL193645 0.95 P2RY1 (0.93) RNASELP2RY1P2RY2SRCP2RX1
Adenosine Triphosphate SCHEMBL28358 0.95 P2RY1 (0.93) RNASELP2RY1P2RY2SRCP2RX1
Adenosine Triphosphate SCHEMBL3459127 0.95 P2RY1 (0.93) RNASELP2RY1P2RY2SRCP2RX1
Adenosine Triphosphate SCHEMBL28356 0.95 P2RY1 (0.93) RNASELP2RY1P2RY2SRCP2RX1
Adenosine Triphosphate SCHEMBL28204853 0.95 P2RY1 (0.93) RNASELP2RY1P2RY2SRCP2RX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4592305-A2 PRODUCTION OF CYCLIC ADENYLATES AND THEIR USE AS ALLOSTERIC REGULATORS Vilnius University (LT) 2025-07-30 — — EP disclosed
EP-3630966-B1 PRODUCTION OF CYCLIC ADENYLATES AND THEIR USE AS ALLOSTERIC REGULATORS UNIV VILNIUS (LT) 2025-04-23 — — EP disclosed
US-12123031-B2 Regulation of CRISPR-associated rossman fold (CARF) domain containing proteins by oligoadenylates VILNIUS UNIVERSITY (LT) 2024-10-22 — — US disclosed