SCHEMBL1934654

SCHEMBL1934654

C=C[C@@]1(n2cnc3c(N)ncnc32)O[C@H](CO)[C@@H](O)[C@H]1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 5/20 0.53
▸ ADORA2A P29274 3/20 0.53
▸ SLC28A1 O00337 2/20 0.50
▸ PI4KA P42356 2/20 0.50
▸ PI4K2B Q8TCG2 2/20 0.50
▸ PI4K2A Q9BTU6 2/20 0.50
▸ PI4KB Q9UBF8 2/20 0.50
▸ GMPS P49915 1/20 0.50
▸ DPP4 P27487 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ MAP3K7 O43318 1/20 0.50
▸ SLC28A2 O43868 1/20 0.50
▸ GAPDH P04406 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ ADORA2B P29275 1/20 0.50
▸ ADORA1 P30542 1/20 0.50
▸ STAT6 P42226 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ DOT1L Q8TEK3 1/20 0.50

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
SCHEMBL3831039 0.89 ADORA3 (0.53) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL29401884 0.89 ADORA3 (0.53) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL31160173 0.88 LMNA (0.40) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL10776201 0.85 ADORA3 (0.49) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL28360308 0.84 P2RY1 (0.49) ADORA1SMN1; SMN2
SCHEMBL6513952 0.83 ADORA3 (0.48) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL6513941 0.83 ADORA3 (0.48) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL29508945 0.83 ADORA3 (0.53) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL4944757 0.83 ADORA3 (0.53) ADORA3ADORA2ASLC28A1PI4KAPI4K2B
SCHEMBL481525 0.82 ADORA3 (0.55) ADORA3ADORA2ASLC28A1PI4KAPI4K2B

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3197457-B1 4'-VINYL SUBSTITUTED NUCLEOSIDE DERIVATIVES AS INHIBITORS OF RESPIRATORY SYNCYTIAL VIRUS RNA REPLICATION RIBOSCIENCE LLC (US) 2022-11-09 — — EP disclosed
US-11446398-B2 Regulated biocircuit systems OBSIDIAN THERAPEUTICS, INC. (US) 2022-09-20 — — US disclosed
US-20190192691-A1 REGULATED BIOCIRCUIT SYSTEMS OBSIDIAN THERAPEUTICS, INC. 2019-06-27 — — US disclosed
EP-1540013-B1 EVOLVING NEW MOLECULAR FUNCTION HARVARD COLLEGE (US) 2015-07-08 — — EP disclosed
EP-1423400-B2 EVOLVING NEW MOLECULAR FUNCTION HARVARD COLLEGE (US) 2013-05-22 — — EP disclosed
US-20120165228-A1 EVOLVING NEW MOLECULAR FUNCTION PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2012-06-28 — — US disclosed
US-8206914-B2 Evolving new molecular function PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-06-26 — — US disclosed
US-7998904-B2 Libraries of oligonucleotides created by genetic engineering PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-08-16 — — US disclosed
US-20110190141-A1 Evolving New Molecular Function PRESIDENT AND FELLOWS OF HAVARD COLLEGE (US) 2011-08-04 — — US disclosed
EP-2332896-A2 Evolving new molecular function President and Fellows of Harvard College (US) 2011-06-15 — — EP disclosed
US-20050142583-A1 Evolving new molecular function PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2005-06-30 — — US disclosed
EP-1540013-A2 EVOLVING NEW MOLECULAR FUNCTION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2005-06-15 — — EP disclosed
US-20050042669-A1 Evolving new molecular function PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2005-02-24 — — US disclosed
US-20050025766-A1 Evolving new molecular function LIU DAVID R (US) 2005-02-03 — — US disclosed
EP-1423400-A4 EVOLVING NEW MOLECULAR FUNCTION HARVARD COLLEGE (US) 2004-12-01 — — EP disclosed
US-20040180412-A1 Evolving new molecular function THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2004-09-16 — — US disclosed
EP-1423400-A2 EVOLVING NEW MOLECULAR FUNCTION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2004-06-02 — — EP disclosed
WO-2004016767-A2 EVOLVING NEW MOLECULAR FUNCTION THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2004-02-26 — — WO disclosed
US-20030113738-A1 Evolving new molecular function PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2003-06-19 — — US disclosed
WO-2002074929-A2 EVOLVING NEW MOLECULAR FUNCTION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2002-09-26 — — WO 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 (2 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-20050025766-A1 Evolving new molecular function POLI, PCNA, POLK ADORA3 1761/4885ADORA2A 1913/4885SLC28A1 3989/4885
US-20120165228-A1 EVOLVING NEW MOLECULAR FUNCTION POLI, PCNA, POLK ADORA3 1761/4885ADORA2A 1913/4885SLC28A1 3989/4885

“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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