SCHEMBL6694591

SCHEMBL6694591

COC(=O)Cn1cnc2c(N)ncnc21

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.60
ADORA2A P29274 6/20 0.59
ADORA1 P30542 4/20 0.59
PI4KA P42356 2/20 0.59
PI4K2B Q8TCG2 2/20 0.59
PI4K2A Q9BTU6 2/20 0.59
PI4KB Q9UBF8 2/20 0.59
ADORA2B P29275 1/20 0.56
ALDH1A1 P00352 1/20 0.56
ADCY5 O95622 5/20 0.55
AHCY P23526 2/20 0.55
SRC P12931 1/20 0.54
KDR P35968 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA4 P22748 1/20 0.54
CA9 Q16790 1/20 0.54

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
SCHEMBL985545 0.86 ADCY5 (0.63) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL29728010 0.86 ADORA2A (0.60) EGFRADORA2AADORA1PI4KAPI4K2B
SCHEMBL1565498 0.86 ADORA2A (0.60) EGFRADORA2AADORA1PI4KAPI4K2B
SCHEMBL9435719 0.85 PI4KA (0.62) EGFRADORA2AADORA1PI4KAPI4K2B
SCHEMBL27713663 0.84 EGFR (0.64) EGFRADORA2AADORA1PI4KAPI4K2B
SCHEMBL6045668 0.83 ADCY5 (0.72) ADORA2AADORA1PI4KAPI4K2BPI4K2A
SCHEMBL1673251 0.82 EGFR (0.70) EGFRADORA2AADORA1PI4KAPI4K2B
SCHEMBL17165347 0.82 EGFR (0.66) EGFRADORA2AADORA1PI4KAPI4K2B
SCHEMBL8839812 0.80 ADORA2A (0.56) EGFRADORA2AADORA1PI4KAPI4K2B
SCHEMBL24709730 0.78 EGFR (0.65) EGFRADORA2AADORA1PI4KAPI4K2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159536-A1 PYRROLOPYRIMIDINE AMINES AS COMPLEMENT INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-05-25 US disclosed
US-6825348-B2 Antiviral compounds ACADEMIA SINICA (TW) 2004-11-30 US disclosed
US-20040002475-A1 Dna genome ACADEMIA SINICA (TW) 2004-01-01 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 (2 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-20230159536-A1 PYRROLOPYRIMIDINE AMINES AS COMPLEMENT INHIBITORS C5, C9, C1QBP EGFR 2721/4885ADORA2A 1283/4885ADORA1 897/4885
US-20040002475-A1 Dna genome DNA2, OGG1, UNG EGFR 2221/4885ADORA2A 122/4885ADORA1 77/4885

“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.