SCHEMBL30433035

SCHEMBL30433035

O=C1CN(CCNCc2cc(=O)n3ccccc3n2)CCN1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ CD274 Q9NZQ7 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.40
▸ ADORA2A P29274 1/20 0.40
▸ ADORA2B P29275 1/20 0.40
▸ ADORA1 P30542 1/20 0.40
▸ METTL3 Q86U44 12/20 0.39
▸ PKM P14618 1/20 0.39
▸ VCP P55072 1/20 0.39
▸ PRKDC P78527 1/20 0.38
▸ METTL14 Q9HCE5 1/20 0.38

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
SCHEMBL30432956 0.73 METTL3 (0.47) CD274KDM4EADORA3ADORA2AADORA2B
SCHEMBL30433498 0.69 METTL3 (0.58) KDM4EADORA3ADORA2AADORA2BADORA1
SCHEMBL23724737 0.69 METTL3 (0.47) CD274KDM4EADORA3ADORA2AADORA2B
SCHEMBL23724700 0.69 METTL3 (0.47) CD274KDM4EADORA3ADORA2AADORA2B
SCHEMBL23724698 0.69 METTL3 (0.47) CD274KDM4EADORA3ADORA2AADORA2B
SCHEMBL30433547 0.69 METTL3 (0.57) KDM4EADORA3ADORA2AADORA2BADORA1
SCHEMBL30432671 0.68 RXFP1 (0.52) ALDH1A1KDM4EADORA3ADORA2AADORA2B
SCHEMBL30433994 0.68 RXFP1 (0.52) ALDH1A1KDM4EADORA3ADORA2AADORA2B
SCHEMBL30433211 0.68 METTL3 (0.62) KDM4EADORA3ADORA2AADORA2BADORA1
SCHEMBL30433263 0.68 METTL3 (0.56) ALDH1A1KDM4EMETTL3METTL14

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 ALDH1A1 172/4885ALOX15 1932/4885TSHR 3784/4885

“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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