SCHEMBL21883347

SCHEMBL21883347

CC1(C)O[C@@H]2[C@H](O1)C(CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)O[C@H]2n1ccc2c(Cl)nc(N)nc21

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NT5E P21589 4/20 0.37
RXFP1 Q9HBX9 1/20 0.36
PRMT5 O14744 2/20 0.34
WDR77 Q9BQA1 2/20 0.34
P2RX1 P51575 1/20 0.34
P2RX3 P56373 1/20 0.34
P2RX4 Q99571 1/20 0.34
ALDH1A1 P00352 1/20 0.33
PI4KA P42356 1/20 0.33
PI4K2B Q8TCG2 1/20 0.33
PI4K2A Q9BTU6 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
APOBEC3G Q9HC16 1/20 0.32
SMYD2 Q9NRG4 1/20 0.31
CYP3A4 P08684 1/20 0.30
EIF4E P06730 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
SCHEMBL21839614 1.00 NT5E (0.37) NT5ERXFP1PRMT5WDR77P2RX1
SCHEMBL21883348 0.90 NT5E (0.33) NT5ERXFP1PRMT5WDR77ALDH1A1
SCHEMBL21839711 0.90 NT5E (0.33) NT5ERXFP1PRMT5WDR77ALDH1A1
SCHEMBL25354004 0.89 RXFP1 (0.39) NT5ERXFP1PRMT5WDR77P2RX1
SCHEMBL12374615 0.89 RXFP1 (0.39) NT5ERXFP1PRMT5WDR77P2RX1
SCHEMBL22334000 0.89 RXFP1 (0.39) NT5ERXFP1PRMT5WDR77P2RX1
SCHEMBL18572819 0.81 PRMT5 (0.34) NT5ERXFP1PRMT5WDR77P2RX1
SCHEMBL22975448 0.80 ADORA3 (0.39) NT5E
SCHEMBL25352432 0.80 PI4KA (0.50) RXFP1PRMT5WDR77P2RX1P2RX3
SCHEMBL30536344 0.80 PI4KA (0.50) RXFP1PRMT5WDR77P2RX1P2RX3

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-20200115404-A1 CD73 INHIBITORS AND USES THEREOF PELOTON THERAPEUTICS INC. 2020-04-16 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-20200115404-A1 CD73 INHIBITORS AND USES THEREOF ENTPD5, ENTPD1, NT5E NT5E 3/4885RXFP1 1796/4885PRMT5 1413/4885

“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.