SCHEMBL20008181

SCHEMBL20008181

CCn1cnc2c(NC(=O)c3ccccc3)ncnc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 6/20 0.58
ADORA1 P30542 6/20 0.58
TMIGD3 P0DMS9 4/20 0.58
ADORA2B P29275 1/20 0.58
PDE4A P27815 1/20 0.50
PDE4B Q07343 1/20 0.50
PDE4C Q08493 1/20 0.50
PDE4D Q08499 1/20 0.50
FLT4 P35916 1/20 0.48
KDR P35968 1/20 0.48
EGFR P00533 1/20 0.48
HTT P42858 1/20 0.46
PI4KA P42356 1/20 0.46
PI4K2B Q8TCG2 1/20 0.46
PI4K2A Q9BTU6 1/20 0.46
PI4KB Q9UBF8 1/20 0.46
TDP1 Q9NUW8 1/20 0.45
ABL1 P00519 1/20 0.45
ADORA3 P0DMS8 1/20 0.44
BRD4 O60885 1/20 0.44

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
SCHEMBL26230945 0.88 P2RY1 (0.47) ADORA2AADORA1TMIGD3ADORA2BPDE4A
SCHEMBL3457849 0.88 EGFR (0.54) ADORA2AADORA1PDE4APDE4BPDE4C
SCHEMBL9702446 0.86 CYP1A2 (0.51) ADORA2AADORA1TMIGD3PDE4APDE4B
SCHEMBL7263226 0.86 ADORA2A (0.52) ADORA2AADORA1TMIGD3ADORA2BPDE4A
SCHEMBL7262510 0.86 ADORA2A (0.52) ADORA2AADORA1TMIGD3ADORA2BPDE4A
SCHEMBL7262512 0.86 ADORA2A (0.52) ADORA2AADORA1TMIGD3ADORA2BPDE4A
SCHEMBL26230942 0.86 P2RY1 (0.47) ADORA2AADORA1TMIGD3ADORA2BPDE4A
SCHEMBL31087988 0.85 NPC1 (0.49) ADORA2AADORA1TMIGD3ADORA2BPDE4A
SCHEMBL8646398 0.85 FLT4 (0.50) ADORA2AADORA1TMIGD3ADORA2BPDE4A
SCHEMBL2758372 0.83 CDK1 (0.56) ADORA2AADORA1ADORA3BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11384105-B2 Processes for preparing oligomers SAREPTA THERAPEUTICS, INC. (US) 2022-07-12 US disclosed
US-20210198296-A1 PROCESSES FOR PREPARING OLIGOMERS SAREPTA THERAPEUTICS, INC. (US) 2021-07-01 US disclosed
US-20210087220-A1 PRODUCTION OF HIGHLY FAT-SOLUBLE PHOSPHORAMIDITE KNC LABORATORIES CO., LTD. (JP) 2021-03-25 US disclosed
US-10947533-B2 Processes for preparing phosphorodiamidate morpholino oligomers SAREPTA THERAPEUTICS, INC. (US) 2021-03-16 US disclosed
US-20200407392-A1 LNA-DICARBOXYLIC ACID DERIVATIVES AND PROCESS FOR THEIR PREPARATION HOFFMANN-LA ROCHE INC. (US) 2020-12-31 US disclosed
US-10875880-B2 Processes for preparing oligomers SAREPTA THERAPEUTICS, INC. (US) 2020-12-29 US disclosed
US-20200040020-A1 PROCESSES FOR PREPARING OLIGOMERS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2020-02-06 US disclosed
WO-2018057430-A1 SYNTHESIS OF BACKBONE MODIFIED MORPHOLINO OLIGONUCLEOTIDES AND CHIMERAS USING PHOSPHORAMIDITE CHEMISTRY THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2018-03-29 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 (6 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-20200040020-A1 PROCESSES FOR PREPARING OLIGOMERS NOP2, PCBP1, RNGTT ADORA2A 4356/4885ADORA1 4299/4885TMIGD3 3966/4885
US-20200407392-A1 LNA-DICARBOXYLIC ACID DERIVATIVES AND PROCESS FOR THEIR PREPARATION POLR2H, POLRMT, SLC16A1 ADORA2A 1310/4885ADORA1 528/4885TMIGD3 4695/4885
US-20210087220-A1 PRODUCTION OF HIGHLY FAT-SOLUBLE PHOSPHORAMIDITE RNGTT, POLR2A, POLR2H ADORA2A 360/4885ADORA1 204/4885TMIGD3 4874/4885
US-20210198296-A1 PROCESSES FOR PREPARING OLIGOMERS PCBP1, RNGTT, PHAX ADORA2A 4556/4885ADORA1 4549/4885TMIGD3 4175/4885
US-10875880-B2 Processes for preparing oligomers NOP2, PCBP1, RNGTT ADORA2A 4356/4885ADORA1 4299/4885TMIGD3 3966/4885
US-11384105-B2 Processes for preparing oligomers NOP2, RNGTT, PCBP1 ADORA2A 4483/4885ADORA1 4477/4885TMIGD3 3884/4885

“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.