SCHEMBL21074014

SCHEMBL21074014

COc1ccc(-c2ccccc2C(OC[C@H]2O[C@@H](c3cnn4c(=O)[nH]cnc34)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O[PH](=O)O)c2ccccc2-c2ccc(OC)cc2)cc1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ KMT2A Q03164 1/20 0.30

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
SCHEMBL21074015 0.91 TYMP (0.31) —
SCHEMBL20214586 0.82 — —
SCHEMBL20214575 0.73 TYMP (0.53) —
SCHEMBL25495879 0.65 — —
SCHEMBL21073968 0.65 — —
SCHEMBL25495885 0.63 — —
SCHEMBL22401436 0.63 TYMP (0.69) —
SCHEMBL21073946 0.61 TYMP (0.52) MAPT
SCHEMBL21431191 0.59 TYMP (0.44) —
SCHEMBL15549481 0.59 PNP (0.41) MEN1MAPTKMT2A

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-20210137962-A9 CYCLIC DINUCLEOTIDE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-05-13 — — US disclosed
US-10980825-B2 Cyclic dinucleotide TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-04-20 — — US disclosed
US-20190192549-A1 CYCLIC DINUCLEOTIDE TAKEDA PHARMACEUTICALS CO (JP) 2019-06-27 — — 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 (3 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-20210137962-A9 CYCLIC DINUCLEOTIDE STING1, CGAS, MAVS MEN1 2290/4885MAPT 4699/4885HPGD 1108/4885
US-10980825-B2 Cyclic dinucleotide STING1, CGAS, MAVS MEN1 2290/4885MAPT 4699/4885HPGD 1108/4885
US-20190192549-A1 CYCLIC DINUCLEOTIDE STING1, CGAS, MAVS MEN1 2290/4885MAPT 4699/4885HPGD 1108/4885

“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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