SCHEMBL21311194

SCHEMBL21311194

Nc1ncnc2c1ncn2C1(O)COC(CNC(=O)C23CC4CC(CC(C4)C2)C3)C1O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PI4KA P42356 1/20 0.48
▸ PI4K2B Q8TCG2 1/20 0.48
▸ PI4K2A Q9BTU6 1/20 0.48
▸ PI4KB Q9UBF8 1/20 0.48
▸ ADORA3 P0DMS8 3/20 0.40
▸ ADORA2A P29274 3/20 0.40
▸ SLC28A1 O00337 2/20 0.40
▸ HSP90B1 P14625 4/20 0.40
▸ GMPS P49915 1/20 0.38
▸ AHCY P23526 1/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ PDE4B Q07343 1/20 0.36
▸ PDE4C Q08493 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ PDE3B Q13370 1/20 0.36
▸ PDE3A Q14432 1/20 0.36
▸ SLC28A2 O43868 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35

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
SCHEMBL21311195 0.81 EGFR (0.44) AHCY
SCHEMBL21311193 0.80 DOT1L (0.38) ADORA3ADORA2ASLC28A1GMPS
SCHEMBL23025515 0.78 ADORA3 (0.53) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL21311216 0.78 ADORA2A (0.47) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL25521510 0.78 ADORA3 (0.53) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL21311472 0.78 CHKA (0.41) PI4KAPI4K2BPI4K2API4KBSLC28A2
SCHEMBL21311476 0.78 DOT1L (0.41) ADORA3ADORA2ASLC28A1GMPS
SCHEMBL20096929 0.78 DOT1L (0.59) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL21311154 0.77 ADORA3 (0.47) PI4KAPI4K2BPI4K2API4KBADORA3
SCHEMBL21311217 0.77 ADORA2A (0.47) PI4KAPI4K2BPI4K2API4KBADORA3

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-20190262371-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF RNA VIRAL INFECTIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-08-29 — — 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-20190262371-A1 METHODS AND COMPOSITION FOR THE TREATMENT OF RNA VIRAL INFECTIONS POLRMT, EIF2AK2, NSUN3 PI4KA 1441/4885PI4K2B 1610/4885PI4K2A 1284/4885

“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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