SCHEMBL22704908

SCHEMBL22704908

CC(C)C(=O)Nc1nc2c(ncn2[C@@H]2O[C@@]3(CO[Si](C)(C)C(C)(C)C)CC3[C@H]2O)c(=O)[nH]1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.46
▸ TAS1R3 Q7RTX0 1/20 0.43
▸ TAS1R1 Q7RTX1 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.37
▸ HINT1 P49773 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ TAAR1 Q96RJ0 2/20 0.35
▸ IMPDH2 P12268 3/20 0.35
▸ IMPDH1 P20839 1/20 0.35
▸ ADORA3 P0DMS8 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ TSHR P16473 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
SCHEMBL26534325 0.87 KDM4E (0.49) KDM4ETAS1R3TAS1R1ALDH1A1HINT1
SCHEMBL26534322 0.87 KDM4E (0.51) KDM4ETAS1R3TAS1R1ALDH1A1HINT1
SCHEMBL22704912 0.87 KDM4E (0.51) KDM4ETAS1R3TAS1R1ALDH1A1HINT1
SCHEMBL24081125 0.84 KDM4E (0.44) KDM4ETAS1R3TAS1R1ALDH1A1HINT1
SCHEMBL22883219 0.80 TAS1R3 (0.62) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL21376697 0.80 KDM4E (0.52) KDM4ETAS1R3TAS1R1ALDH1A1HINT1
SCHEMBL20434944 0.79 TAS1R3 (0.53) KDM4ETAS1R3TAS1R1ALDH1A1HINT1
SCHEMBL18490364 0.79 TAS1R3 (0.54) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL22034192 0.79 TAS1R3 (0.54) KDM4ETAS1R3TAS1R1HINT1IMPDH2
SCHEMBL29881515 0.79 TAS1R3 (0.54) KDM4ETAS1R3TAS1R1HINT1IMPDH2

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-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators ALIGOS THERAPEUTICS, INC. (US) 2023-10-17 — — US disclosed
US-20200369711-A1 MODIFIED CYCLIC DINUCLEOSIDE COMPOUNDS AS STING MODULATORS ALIGOS THERAPEUTICS, INC. 2020-11-26 — — 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-20200369711-A1 MODIFIED CYCLIC DINUCLEOSIDE COMPOUNDS AS STING MODULATORS STING1, CGAS, IRF3 KDM4E 3225/4885TAS1R3 2072/4885TAS1R1 1825/4885
US-11787833-B2 Modified cyclic dinucleoside compounds as sting modulators STING1, CGAS, IRF3 KDM4E 3225/4885TAS1R3 2072/4885TAS1R1 1825/4885

“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.

Send feedback