SCHEMBL23920872

SCHEMBL23920872

O=c1c2nc(Br)n(CCO)c2nc2[nH]c(-c3ccc(C(F)(F)F)cc3)cn12

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
ADORA3 P0DMS8 6/20 0.38
ADORA1 P30542 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
TNKS O95271 2/20 0.34
PARP1 P09874 2/20 0.34
TNKS2 Q9H2K2 2/20 0.34
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PDE2A O00408 2/20 0.33
PNP P00491 1/20 0.33
CTSS P25774 1/20 0.33

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
SCHEMBL23921079 0.89 ADORA3 (0.46) ADORA3ADORA1TDP1ADORA2AADORA2B
SCHEMBL23921157 0.88 TDP1 (0.41) ADORA3ADORA1TDP1ADORA2AADORA2B
SCHEMBL23921120 0.88 ADORA3 (0.41) ADORA3ADORA1TDP1ADORA2AADORA2B
SCHEMBL21396528 0.87 ADORA1 (0.40) ADORA3ADORA1TDP1TNKSPARP1
SCHEMBL21396504 0.87 ADORA3 (0.42) ADORA3ADORA1TDP1TNKSPARP1
SCHEMBL23921015 0.87 ADORA3 (0.40) MEN1POLBKMT2AADORA3ADORA1
SCHEMBL23921240 0.87 ADORA3 (0.51) ADORA3ADORA1TDP1ADORA2AADORA2B
SCHEMBL23921239 0.84 ADORA3 (0.38) ADORA3ADORA1TDP1ADORA2AADORA2B
SCHEMBL23921154 0.84 ADORA3 (0.49) MEN1KMT2AADORA3ADORA1TDP1
SCHEMBL21396379 0.82 ADORA3 (0.40) ADORA3ADORA1TDP1ADORA2AADORA2B

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 MEN1 2620/4885POLB 1465/4885KMT2A 2118/4885
US-20210317156-A1 NEW POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES PRKG1, PRKG2, PDE7A MEN1 2840/4885POLB 1528/4885KMT2A 2369/4885

“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.