SCHEMBL21118446

SCHEMBL21118446

CCCC(C)(CC)n1cnc2c(N)ncnc21

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 7/20 0.67
PI4K2B Q8TCG2 7/20 0.67
PI4K2A Q9BTU6 7/20 0.67
PI4KB Q9UBF8 7/20 0.67
ADORA2A P29274 8/20 0.52
ADORA1 P30542 7/20 0.52
ADORA2B P29275 3/20 0.52
ALDH1A1 P00352 1/20 0.42
AHCY P23526 1/20 0.42

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
SCHEMBL22020877 0.94 PI4KA (0.67) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL22666442 0.92 PI4KA (0.63) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL22666249 0.91 PI4KA (0.74) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL21372144 0.89 PI4KA (0.60) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL22142993 0.87 PI4KA (0.57) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL21090693 0.85 PI4KA (0.67) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL23692926 0.83 PI4KA (0.60) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL25768221 0.83 PI4KA (0.60) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL26639075 0.83 PI4KA (0.60) PI4KAPI4K2BPI4K2API4KBADORA2A
SCHEMBL18659819 0.83 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBADORA2A

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-11795192-B2 Antimicrobial compounds, compositions, and uses thereof Lakewood Amedex, Inc. (US) 2023-10-24 US disclosed
US-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators ALIGOS THERAPEUTICS, INC. (US) 2023-10-17 US disclosed
US-20230287034-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN BIOTECH INC (US) 2023-09-14 US disclosed
US-20230159536-A1 PYRROLOPYRIMIDINE AMINES AS COMPLEMENT INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-05-25 US disclosed
US-20210277046-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN PHARMACEUTICA NV (BE) 2021-09-09 US disclosed
US-11021511-B2 Cyclic dinucleotides as sting agonists JANSSEN BIOTECH, INC. (US) 2021-06-01 US disclosed
US-20200369711-A1 MODIFIED CYCLIC DINUCLEOSIDE COMPOUNDS AS STING MODULATORS ALIGOS THERAPEUTICS, INC. 2020-11-26 US disclosed
US-20190185511-A1 LOCKED NUCLEIC ACID CYCLIC DINUCLEOTIDE COMPOUNDS AND USES THEREOF Aduro Biotech, Inc. (US) 2019-06-20 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 (8 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 PI4KA 2356/4885PI4K2B 2404/4885PI4K2A 2526/4885
US-20190185511-A1 LOCKED NUCLEIC ACID CYCLIC DINUCLEOTIDE COMPOUNDS AND USES THEREOF STING1, TLR9, IFNAR1 PI4KA 1252/4885PI4K2B 1656/4885PI4K2A 1470/4885
US-20230287034-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS STING1, CGAS, IFNAR1 PI4KA 2386/4885PI4K2B 2341/4885PI4K2A 2482/4885
US-20210277046-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS STING1, CGAS, IFNAR1 PI4KA 2378/4885PI4K2B 2290/4885PI4K2A 2437/4885
US-20200369711-A1 MODIFIED CYCLIC DINUCLEOSIDE COMPOUNDS AS STING MODULATORS STING1, CGAS, IRF3 PI4KA 2127/4885PI4K2B 2225/4885PI4K2A 2155/4885
US-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators STING1, CGAS, IRF3 PI4KA 2127/4885PI4K2B 2225/4885PI4K2A 2155/4885
US-11021511-B2 Cyclic dinucleotides as sting agonists STING1, CGAS, MAVS PI4KA 2390/4885PI4K2B 1643/4885PI4K2A 1854/4885
US-11795192-B2 Antimicrobial compounds, compositions, and uses thereof CAT, MPO, NISCH PI4KA 1930/4885PI4K2B 2372/4885PI4K2A 2532/4885

“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.