SCHEMBL25390285

SCHEMBL25390285

CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](OC(=O)c2ccccc2)[C@@H](CO)O[C@H]1n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 1/20 0.53
▸ TAS1R1 Q7RTX1 1/20 0.53
▸ HPGD P15428 2/20 0.50
▸ HINT1 P49773 6/20 0.48
▸ PNP P00491 1/20 0.48
▸ GSK3A P49840 2/20 0.48
▸ RPS6KA3 P51812 2/20 0.48
▸ MAPK14 Q16539 2/20 0.48
▸ TAAR1 Q96RJ0 2/20 0.47
▸ P2RX3 P56373 1/20 0.44
▸ P2RX4 Q99571 1/20 0.44
▸ P2RX2 Q9UBL9 1/20 0.44
▸ P2RY11 Q96G91 1/20 0.44
▸ NT5E P21589 1/20 0.43
▸ STING1 Q86WV6 1/20 0.41
▸ KRAS P01116 1/20 0.41

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
SCHEMBL29479244 1.00 TAS1R3 (0.53) TAS1R3TAS1R1HPGDHINT1PNP
SCHEMBL24377160 1.00 TAS1R3 (0.53) TAS1R3TAS1R1HPGDHINT1PNP
SCHEMBL24377169 0.92 TAS1R3 (0.52) TAS1R3TAS1R1HPGDHINT1PNP
SCHEMBL16870493 0.91 TAS1R3 (0.57) TAS1R3TAS1R1HPGDHINT1PNP
SCHEMBL16866669 0.87 TAS1R3 (0.55) TAS1R3TAS1R1HPGDHINT1PNP
SCHEMBL29479248 0.86 HINT1 (0.59) TAS1R3TAS1R1HPGDHINT1PNP
SCHEMBL29972968 0.86 TAS1R3 (0.62) TAS1R3TAS1R1HPGDHINT1PNP
SCHEMBL24377105 0.86 KDM4E (0.49) TAS1R3TAS1R1HPGDHINT1TAAR1
SCHEMBL25387607 0.86 KDM4E (0.49) TAS1R3TAS1R1HPGDHINT1TAAR1
SCHEMBL29973219 0.86 KDM4E (0.49) TAS1R3TAS1R1HPGDHINT1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240059729-A1 MULTIFUNCTIONAL CYCLIC DINUCLEOTIDE AND USE THEREOF TYLIGAND BIOSCIENCE (SHANGHAI) LIMITED (CN) 2024-02-22 — — US disclosed
EP-4242218-A1 MULTIFUNCTIONAL CYCLIC DINUCLEOTIDE AND USE THEREOF Tyligand Bioscience (Shanghai) Limited (CN) 2023-09-13 — — EP disclosed
WO-2022083584-A1 MULTIFUNCTIONAL CYCLIC DINUCLEOTIDE AND USE THEREOF 泰励生物科技(上海)有限公司 2022-04-28 — — 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 (1 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-20240059729-A1 MULTIFUNCTIONAL CYCLIC DINUCLEOTIDE AND USE THEREOF MAVS, IRF3, STING1 TAS1R3 4161/4885TAS1R1 4092/4885HPGD 155/4885

“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.

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