SCHEMBL23920903

SCHEMBL23920903

CC(C)c1ccc(-c2nc3c(=O)n4cc(-c5ccccc5)[nH]c4nc3n2CCO)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 8/20 0.48
ADORA1 P30542 3/20 0.48
BCL2 P10415 1/20 0.41
MCL1 Q07820 1/20 0.41
DHFR P00374 1/20 0.40
DHODH Q02127 1/20 0.39
CASR P41180 2/20 0.38
TP53 P04637 1/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
HSD17B10 Q99714 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP2C9 P11712 1/20 0.37
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL21396436 0.91 ADORA3 (0.52) ADORA3ADORA1BCL2MCL1DHODH
SCHEMBL21396430 0.90 ADORA3 (0.47) ADORA3ADORA1DHODHTP53KDM4E
SCHEMBL23921070 0.89 ADORA3 (0.48) ADORA3ADORA1BCL2MCL1DHODH
SCHEMBL21396458 0.86 ADORA3 (0.45) ADORA3ADORA1BCL2MCL1DHFR
SCHEMBL23920988 0.85 ADORA3 (0.44) ADORA3ADORA1BCL2MCL1TP53
SCHEMBL23921240 0.80 ADORA3 (0.51) ADORA3ADORA1TP53TDP1
SCHEMBL21396354 0.80 ADORA3 (0.51) ADORA3ADORA1TP53KDM4EMEN1
SCHEMBL23921233 0.80 ADORA3 (0.51) ADORA3ADORA1TP53KDM4EMEN1
SCHEMBL23920978 0.78 ADORA3 (0.52) ADORA3ADORA1TP53KDM4EALDH1A1
SCHEMBL23920929 0.77 ADORA3 (0.46) ADORA3ADORA1DHODHTP53KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242568-A1 POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES MIRECA MEDICINES GMBH (DE) 2023-08-03 US disclosed
US-20210317156-A1 NEW POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES MIRECA MEDICINES GMBH (DE) 2021-10-14 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-20230242568-A1 POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES PRKG1, PRKG2, PRKAG3 ADORA3 425/4885ADORA1 857/4885BCL2 4661/4885
US-20210317156-A1 NEW POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES PRKG1, PRKG2, PDE7A ADORA3 449/4885ADORA1 828/4885BCL2 4735/4885

“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.