SCHEMBL25826462

SCHEMBL25826462

Cc1cc(Cc2ccc3[nH]c(-c4ccc(Nc5ccnc6ccc(N(C)C)cc56)nc4)nc3n2)ccn1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 7/20 0.37
▸ AURKA O14965 8/20 0.35
▸ TLR8 Q9NR97 4/20 0.34
▸ TLR7 Q9NYK1 4/20 0.34
▸ TLR9 Q9NR96 3/20 0.34
▸ KIF11 P52732 1/20 0.33
▸ TCF4 P15884 1/20 0.32
▸ CTNNB1 P35222 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
SCHEMBL25826446 0.90 KDR (0.46) KDRAURKA
SCHEMBL30180545 0.86 KDR (0.41) KDRAURKAKIF11TCF4CTNNB1
SCHEMBL23999658 0.86 KDR (0.41) KDRAURKAKIF11TCF4CTNNB1
SCHEMBL25826379 0.83 KDR (0.35) KDRAURKATLR8TLR7TLR9
SCHEMBL30180637 0.80 KDR (0.45) KDRAURKATCF4CTNNB1
SCHEMBL23999674 0.80 KDR (0.45) KDRAURKATCF4CTNNB1
SCHEMBL30180266 0.79 KDR (0.39) KDRAURKATCF4CTNNB1
SCHEMBL23999443 0.79 KDR (0.39) KDRAURKATCF4CTNNB1
SCHEMBL23999653 0.78 KDR (0.48) KDRAURKA
SCHEMBL30180308 0.78 KDR (0.48) KDRAURKA

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-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 — — 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-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR KDR 3271/4885AURKA 2441/4885TLR8 2961/4885

“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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