SCHEMBL20325366

SCHEMBL20325366

CCn1cnc2c(=O)[nH]ncc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 4/20 0.36
PDE4A P27815 4/20 0.36
PDE4B Q07343 4/20 0.36
PDE4C Q08493 4/20 0.36
PDE4D Q08499 4/20 0.36
ADORA1 P30542 1/20 0.36
PI4KA P42356 1/20 0.36
PI4K2B Q8TCG2 1/20 0.36
PI4K2A Q9BTU6 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35
BRD4 O60885 4/20 0.35
BRD2 P25440 2/20 0.35
BRD3 Q15059 2/20 0.35
BRDT Q58F21 2/20 0.35
RAB9A P51151 1/20 0.32

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
SCHEMBL8043797 0.77 GDA (0.36) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL22326779 0.74 ALDH1A1 (0.34) ADORA2APDE4BSMN1; SMN2RAB9APOLB
SCHEMBL23679501 0.74 SLC2A1 (0.33) ADORA2APDE4BSMN1; SMN2RAB9APOLB
SCHEMBL18520821 0.73 SMN1; SMN2 (0.40) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL21637050 0.73 TDP1 (0.37) PI4KAPI4K2BPI4K2API4KB
SCHEMBL13181197 0.73 SMN1; SMN2 (0.38) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL18521156 0.71 PNP (0.45) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL23228226 0.71 BRD4 (0.39) ADORA2APDE4APDE4BPDE4CPDE4D
SCHEMBL22883503 0.71 SLC2A1 (0.33) PI4KAPI4K2BPI4K2API4KB
SCHEMBL23867234 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773132-B2 Cyclic di-nucleotides as stimulator of interferon genes modulators BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2023-10-03 US disclosed
US-20200331957-A1 CYCLIC DI-NUCLEOTIDES AS STIMULATOR OF INTERFERON GENES MODULATORS AJ SCIENCES (YIXING) CO., LTD (CN) 2020-10-22 US disclosed
WO-2020117624-A1 CYCLIC DI-NUCLEOTIDE COMPOUNDS AS STING AGONISTS MERCK SHARP & DOHME CORP. (US) 2020-06-11 WO disclosed
WO-2019043634-A2 CYCLIC DI-NUCLEOTIDES AS STIMULATOR OF INTERFERON GENES MODULATORS BEIJING XUANYI PHARMASCIENCES CO., LTD. (CN) 2019-03-07 WO disclosed
WO-2018118664-A1 COMBINATIONS OF PD-1 ANTAGONISTS AND CYCLIC DINUCLEOTIDE STING AGONISTS FOR CANCER TREATMENT MERCK SHARP & DOHME CORP. (US) 2018-06-28 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 (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-20200331957-A1 CYCLIC DI-NUCLEOTIDES AS STIMULATOR OF INTERFERON GENES MODULATORS STING1, IRF3, CGAS ADORA2A 216/4885PDE4A 30/4885PDE4B 72/4885
US-11773132-B2 Cyclic di-nucleotides as stimulator of interferon genes modulators STING1, IRF3, CGAS ADORA2A 216/4885PDE4A 30/4885PDE4B 72/4885

“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.