SCHEMBL25495992

SCHEMBL25495992

CC[C@H]1O[C@@](O)(c2cnc3c(N)ncnn23)[C@@H](OCc2ccccc2)C1C

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TNK2 Q07912 3/20 0.35
▸ HSPA5 P11021 1/20 0.31
▸ RET P07949 1/20 0.31
▸ AHCY P23526 1/20 0.30
▸ AXL P30530 1/20 0.30
▸ MERTK Q12866 1/20 0.30
▸ NTRK1 P04629 1/20 0.30
▸ NTRK2 Q16620 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
SCHEMBL18510823 1.00 TNK2 (0.35) TNK2HSPA5RETAHCYAXL
SCHEMBL19758149 0.87 TSHR (0.31) TNK2
SCHEMBL17131351 0.87 TSHR (0.31) TNK2
SCHEMBL10120838 0.86 TNK2 (0.35) TNK2HSPA5NTRK1NTRK2
SCHEMBL18371662 0.86 TNK2 (0.35) TNK2HSPA5NTRK1NTRK2
SCHEMBL17719386 0.86 TNK2 (0.35) TNK2HSPA5NTRK1NTRK2
SCHEMBL10120675 0.86 TNK2 (0.35) TNK2HSPA5NTRK1NTRK2
SCHEMBL20434838 0.83 PDE2A (0.38) TNK2HSPA5
SCHEMBL21759078 0.83 PDE2A (0.38) TNK2HSPA5
SCHEMBL24539016 0.83 PDE2A (0.38) TNK2HSPA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230146410-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN BIOTECH INC (US) 2023-05-11 — — 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 (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-20230146410-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS STING1, CGAS, MAVS TNK2 1069/4885HSPA5 2853/4885RET 1759/4885

“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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