SCHEMBL30237461

SCHEMBL30237461

CCn1c(=O)c2c(nc(/C=C/c3ccc(O)c(OC)c3)n2C)n(CC)c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 7/20 1.00
ADORA3 P0DMS8 2/20 0.83
ADORA2B P29275 2/20 0.83
HTR1A P08908 1/20 0.83
CYP2C9 P11712 1/20 0.83
MAOB P27338 1/20 0.83
PDE4A P27815 1/20 0.83
ADORA1 P30542 1/20 0.83
PDE4D Q08499 1/20 0.83

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
SCHEMBL7289476 1.00 ADORA2A (1.00) ADORA2AADORA3ADORA2BHTR1ACYP2C9
SCHEMBL7289463 1.00 ADORA2A (1.00) ADORA2AADORA3ADORA2BHTR1ACYP2C9
SCHEMBL7305368 0.92 ADORA2A (0.85) ADORA2AADORA3ADORA2BHTR1ACYP2C9
SCHEMBL7544542 0.92 ADORA2A (0.85) ADORA2AADORA3ADORA2BHTR1ACYP2C9
SCHEMBL7544538 0.92 ADORA2A (0.85) ADORA2AADORA3ADORA2BHTR1ACYP2C9
SCHEMBL7305359 0.92 ADORA2A (0.85) ADORA2AADORA3ADORA2BHTR1ACYP2C9
Istradefylline SCHEMBL5967914 0.91 ADORA2A (1.00) ADORA2AADORA3ADORA2BHTR1ACYP2C9
Istradefylline SCHEMBL633262 0.91 ADORA2A (1.00) ADORA2AADORA3ADORA2BHTR1ACYP2C9
Istradefylline SCHEMBL633263 0.91 ADORA2A (1.00) ADORA2AADORA3ADORA2BHTR1ACYP2C9
Istradefylline SCHEMBL29471410 0.91 ADORA2A (1.00) ADORA2AADORA3ADORA2BHTR1ACYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230285556-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER OMEROS CORPORATION 2023-09-14 US claimed
WO-2023039578-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER OMEROS CORPORATION (US) 2023-03-16 WO claimed
US-20230285556-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER OMEROS CORPORATION 2023-09-14 US disclosed
WO-2023039578-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER OMEROS CORPORATION (US) 2023-03-16 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 (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-20230285556-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER TP53, CD4, MCL1 ADORA2A 1801/4885ADORA3 3648/4885ADORA2B 2902/4885

“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.