SCHEMBL30432956

SCHEMBL30432956

O=C1CC[C@@H](CCNCc2cc(=O)n3ccccc3n2)N1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ METTL3 Q86U44 16/20 0.47
▸ KDM4E B2RXH2 1/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ ADORA2A P29274 1/20 0.44
▸ ADORA2B P29275 1/20 0.44
▸ ADORA1 P30542 1/20 0.44
▸ VSIR Q9H7M9 1/20 0.43
▸ CD274 Q9NZQ7 2/20 0.42
▸ PDCD1LG2 Q9BQ51 1/20 0.42
▸ PDCD1 Q15116 1/20 0.42

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
SCHEMBL23724698 0.90 METTL3 (0.47) METTL3KDM4EADORA3ADORA2AADORA2B
SCHEMBL23724737 0.90 METTL3 (0.47) METTL3KDM4EADORA3ADORA2AADORA2B
SCHEMBL23724700 0.90 METTL3 (0.47) METTL3KDM4EADORA3ADORA2AADORA2B
SCHEMBL30433213 0.78 DRD4 (0.53) METTL3KDM4EADORA3ADORA2AADORA2B
SCHEMBL30432621 0.78 DRD4 (0.53) METTL3KDM4EADORA3ADORA2AADORA2B
SCHEMBL23726593 0.74 KDM4E (0.45) KDM4ECD274PDCD1LG2PDCD1
SCHEMBL30433263 0.73 METTL3 (0.56) METTL3KDM4E
SCHEMBL30433035 0.73 ALDH1A1 (0.45) METTL3KDM4EADORA3ADORA2AADORA2B
SCHEMBL30433498 0.71 METTL3 (0.58) METTL3KDM4EADORA3ADORA2AADORA2B
SCHEMBL30433547 0.71 METTL3 (0.57) METTL3KDM4EADORA3ADORA2AADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230143612-A1 SUBSTITUTED 1,1'-BIPHENYL COMPOUNDS AND METHODS USING SAME ARBUTUS BIOPHARMA CORP (US) 2023-05-11 — — 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-20230143612-A1 SUBSTITUTED 1,1'-BIPHENYL COMPOUNDS AND METHODS USING SAME HAVCR2, HMBS, VHL METTL3 773/4885KDM4E 224/4885ADORA3 456/4885

“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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