SCHEMBL29501809

SCHEMBL29501809

OCCn1cnc2c(NCc3cccc(I)c3)ncnc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 12/20 0.59
ADORA2A P29274 10/20 0.59
ADORA1 P30542 8/20 0.59
ADORA2B P29275 2/20 0.59
TMIGD3 P0DMS9 1/20 0.58
RAB9A P51151 1/20 0.55
KMT2A Q03164 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
SCHEMBL28068467 0.86 TMIGD3 (0.77) ADORA3ADORA2AADORA1ADORA2BTMIGD3
SCHEMBL3049180 0.85 ADORA3 (0.58) ADORA3ADORA2AADORA1ADORA2B
SCHEMBL3055654 0.85 ADORA3 (0.58) ADORA3ADORA2AADORA1ADORA2B
SCHEMBL29501856 0.85 ADORA3 (0.58) ADORA3ADORA2AADORA1ADORA2B
SCHEMBL29501915 0.84 ADORA2A (0.53) ADORA3ADORA2AADORA1ADORA2BTMIGD3
SCHEMBL22349409 0.84 CDK1 (0.73) ADORA3ADORA2AADORA1
SCHEMBL29501881 0.84 CDK1 (0.73) ADORA3ADORA2AADORA1
SCHEMBL29703267 0.79 PPARG (0.76) ADORA3ADORA2AADORA1
SCHEMBL29703231 0.79 PPARG (0.76) ADORA3ADORA2AADORA1
SCHEMBL29703233 0.79 PPARG (0.76) ADORA3ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260115218-A1 TREATMENT OF ADVANCED METASTATIC CANCER CAN-FITE BIOPHARMA LTD. (IL) 2026-04-30 US disclosed
US-12213990-B2 A3 adenosine receptor ligand for use for achieving a fat loss effect CAN-FITE BIOPHARMA LTD. (IL) 2025-02-04 US disclosed
EP-3530273-B1 A3 ADENOSINE RECEPTOR LIGANDS FOR USE IN THE TREATMENT OF A SEXUAL DYSFUNCTION CAN FITE BIOPHARMA LTD (IL) 2024-08-14 EP disclosed
US-20230201240-A1 TREATMENT OF ADVANCED METASTATIC CANCER CAN-FITE BIOPHARMA LTD. (IL) 2023-06-29 US disclosed
US-11291681-B2 Method for treating fibrotic liver tissue using Cl-IB-MECA CAN-FITE BIOPHARMA LTD. (IL) 2022-04-05 US disclosed
US-20220079968-A1 AN A3 ADENOSINE RECEPTOR LIGAND FOR USE FOR ACHIEVING A FAT LOSS EFFECT CAN-FITE BIOPHARMA LTD. (IL) 2022-03-17 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 (5 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-11291681-B2 Method for treating fibrotic liver tissue using Cl-IB-MECA GPR119, FABP1, INSR ADORA3 12/4885ADORA2A 4/4885ADORA1 18/4885
US-20220079968-A1 AN A3 ADENOSINE RECEPTOR LIGAND FOR USE FOR ACHIEVING A FAT LOSS EFFECT ADORA2A, ADORA3, FABP4 ADORA3 2/4885ADORA2A 1/4885ADORA1 4/4885
US-20230201240-A1 TREATMENT OF ADVANCED METASTATIC CANCER ADORA3, ADORA2A, ADORA1 ADORA3 1/4885ADORA2A 2/4885ADORA1 3/4885
US-20260115218-A1 TREATMENT OF ADVANCED METASTATIC CANCER ADORA2B, ADORA3, ADORA2A ADORA3 2/4885ADORA2A 3/4885ADORA1 4/4885
US-12213990-B2 A3 adenosine receptor ligand for use for achieving a fat loss effect ADORA3, ADORA2A, FABP4 ADORA3 1/4885ADORA2A 2/4885ADORA1 4/4885

“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.