SCHEMBL23429773

SCHEMBL23429773

C=C[C@]12C[C@@H]1[C@@H](n1c(C)cc3c(N)ncnc31)[C@@H]1OC(C)(C)O[C@@H]12

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 1/20 0.33
▸ PI4K2B Q8TCG2 1/20 0.33
▸ PI4K2A Q9BTU6 1/20 0.33
▸ PI4KB Q9UBF8 1/20 0.33
▸ RAPGEF3 O95398 1/20 0.32
▸ PRMT5 O14744 1/20 0.31
▸ LRRK2 Q5S007 1/20 0.31
▸ RXFP1 Q9HBX9 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
SCHEMBL23405239 1.00 PI4KA (0.33) PI4KAPI4K2BPI4K2API4KBRAPGEF3
SCHEMBL29911230 0.88 — —
SCHEMBL23429993 0.88 — —
SCHEMBL23405284 0.88 — —
SCHEMBL22521454 0.82 PRMT5 (0.42) RAPGEF3PRMT5
SCHEMBL21061719 0.82 PRMT5 (0.42) RAPGEF3PRMT5
SCHEMBL23430012 0.82 PRMT5 (0.42) RAPGEF3PRMT5
SCHEMBL29522691 0.82 PRMT5 (0.42) RAPGEF3PRMT5
SCHEMBL23429861 0.78 HRH2 (0.30) —
SCHEMBL23405183 0.78 HRH2 (0.30) —

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-20210163486-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS LUPIN LIMITED (IN) 2021-06-03 — — 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-20210163486-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS PRMT5 INHIBITORS PRMT5, PRMT1, PRMT3 PI4KA 3842/4885PI4K2B 3728/4885PI4K2A 3892/4885

“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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