SCHEMBL3831039

SCHEMBL3831039

Nc1ncnc2c1ncn2[C@]1(C=O)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
▸ PI4KA P42356 2/20 0.50
▸ PI4K2B Q8TCG2 2/20 0.50
▸ PI4K2A Q9BTU6 2/20 0.50
▸ PI4KB Q9UBF8 2/20 0.50
▸ SLC28A1 O00337 2/20 0.50
▸ ADORA1 P30542 2/20 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
▸ 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
▸ SLC29A1 Q99808 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
SCHEMBL29401884 1.00 ADORA3 (0.53) ADORA3ADORA2API4KAPI4K2BPI4K2A
SCHEMBL1934654 0.89 ADORA3 (0.53) ADORA3ADORA2API4KAPI4K2BPI4K2A
SCHEMBL10776201 0.85 ADORA3 (0.49) ADORA3ADORA2API4KAPI4K2BPI4K2A
SCHEMBL31547787 0.84 ADORA3 (0.44) ADORA3ADORA2API4KAPI4K2BPI4K2A
SCHEMBL6513941 0.83 ADORA3 (0.48) ADORA3ADORA2API4KAPI4K2BPI4K2A
SCHEMBL6513952 0.83 ADORA3 (0.48) ADORA3ADORA2API4KAPI4K2BPI4K2A
SCHEMBL30223675 0.83 ADORA3 (0.53) ADORA3ADORA2API4KAPI4K2BPI4K2A
SCHEMBL22360999 0.83 ADORA3 (0.56) ADORA3ADORA2API4KAPI4K2BPI4K2A
SCHEMBL27356878 0.83 ADORA3 (0.53) ADORA3ADORA2API4KAPI4K2BPI4K2A
SCHEMBL8003530 0.83 ADORA3 (0.53) ADORA3ADORA2API4KAPI4K2BPI4K2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230381102-A1 RINSE-OFF COMPOSITIONS AND USES THEREOF FOR DELIVERY OF ACTIVE AGENTS CRESCITA THERAPEUTICS INC. (CA) 2023-11-30 — — US claimed
EP-4676241-A1 COMPOSITIONS CONTAINING PARAXANTHINE AND BETA-HYDROXYBUTYRATE OR PRECURSOR FOR INCREASING NEUROLOGICAL AND PHYSIOLOGICAL PERFORMANCE Axcess Global Sciences, LLC (US) 2026-01-14 — — EP disclosed
US-12465564-B2 Oral and nasal compositions and methods of treatment AQUESTIVE THERAPEUTICS, INC. (US) 2025-11-11 — — US disclosed
EP-4642475-A2 ARTIFICIAL SECRETION PEPTIDES FOR HETEROLOGOUS PROTEIN PRODUCTION Tenza, Inc. (US) 2025-11-05 — — EP disclosed
EP-4585264-A2 HUMAN CGRP RECEPTOR BINDING PROTEINS AMGEN INC. (US) 2025-07-16 — — EP disclosed
WO-2025123127-A1 TOPICAL COMPOSITION AND USE THEREOF TO REDUCE POST-SURGICAL USE OF OPIOIDS KAZM PHARMACEUTICALS INC. (CA) 2025-06-19 — — WO disclosed
EP-4558135-A1 CONTINUOUS DELIVERY SYSTEMS COMPRISING A CANNABINOID AND MEDICINAL USES THEREOF Pike Therapeutics Inc. (CA) 2025-05-28 — — EP disclosed
EP-3569620-B1 HUMAN CGRP RECEPTOR BINDING ANTIBODIES AMGEN INC (US) 2025-05-07 — — EP disclosed
US-20250129172-A1 HUMAN CGRP RECEPTOR BINDING PROTEINS AMGEN INC. (US) 2025-04-24 — — US disclosed
EP-4536209-A2 CONJUGATE FOR TARGETING CENTRAL NERVOUS SYSTEM Suntec Medical, Inc. (US) 2025-04-16 — — EP disclosed
EP-0737201-A4 BACKBONE MODIFIED OLIGONUCLEOTIDE ANALOGS AND SOLID PHASE SYNTHESIS THEREOF ISIS PHARMACEUTICALS INC (US) 1998-12-30 — — EP disclosed
CN-1164259-A Microbiological test method and reagent SECR DEFENCE BRIT (GB) 1997-11-05 — — CN disclosed
EP-0737201-A1 BACKBONE MODIFIED OLIGONUCLEOTIDE ANALOGS AND SOLID PHASE SYNTHESIS THEREOF ISIS PHARMACEUTICALS, INC. (US) 1996-10-16 — — EP disclosed
US-5536823-A 3'-sulfonyl nucleoside compounds INDIANA UNIVERSITY FOUNDATION (US) 1996-07-16 — — US disclosed
WO-1995018136-A1 BACKBONE MODIFIED OLIGONUCLEOTIDE ANALOGS AND SOLID PHASE SYNTHESIS THEREOF ISIS PHARMACEUTICALS, INC. (US) 1995-07-06 — — WO disclosed
EP-0334361-B1 Novel acetylenic, cyano and allenic aristeromycin/adenosine derivatives MERRELL DOW PHARMA (US) 1995-04-19 — — EP disclosed
CN-1023804-C Novel acetylenic, cyano and allenic aristeromycin/adenosine derivatives MERRELL DOW PHARMA (US) 1994-02-16 — — CN disclosed
US-4996308-A Viricides, antitumor agent MERRELL DOW PHARMACEUTICALS INC. (US) 1991-02-26 — — US disclosed
CN-1036579-A Novel acetylenic, cyano group and allenic aristeromycin element/adenosine derivative MERRELL DOW PHARMA (US) 1989-10-25 — — CN disclosed
EP-0334361-A2 Novel acetylenic, cyano and allenic aristeromycin/adenosine derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1989-09-27 — — EP 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-20230381102-A1 RINSE-OFF COMPOSITIONS AND USES THEREOF FOR DELIVERY OF ACTIVE AGENTS PLOD3, DSG1, POLR1C ADORA3 4193/4885ADORA2A 3153/4885PI4KA 2532/4885

“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.

Send feedback