SCHEMBL31533316

SCHEMBL31533316

CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NS(=O)(=O)NC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@@H]2OC(C)(C)O[C@@H]21

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.51
▸ PI4KA P42356 1/20 0.49
▸ PI4K2B Q8TCG2 1/20 0.49
▸ PI4K2A Q9BTU6 1/20 0.49
▸ PI4KB Q9UBF8 1/20 0.49
▸ P2RX1 P51575 1/20 0.45
▸ P2RX3 P56373 1/20 0.45
▸ P2RX4 Q99571 1/20 0.45
▸ DOT1L Q8TEK3 2/20 0.43

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
SCHEMBL7039480 1.00 RXFP1 (0.51) RXFP1PI4KAPI4K2BPI4K2API4KB
SCHEMBL7031903 0.91 LMNA (0.41) RXFP1P2RX3P2RX4
SCHEMBL7036534 0.89 RXFP1 (0.46) RXFP1PI4KAPI4K2BPI4K2API4KB
SCHEMBL7037427 0.86 RXFP1 (0.51) RXFP1PI4KAPI4K2BPI4K2API4KB
SCHEMBL31533317 0.85 RXFP1 (0.53) RXFP1PI4KAPI4K2BPI4K2API4KB
SCHEMBL7037167 0.83 RXFP1 (0.56) RXFP1PI4KAPI4K2BPI4K2API4KB
SCHEMBL30239003 0.83 RXFP1 (0.43) RXFP1PI4KAPI4K2BPI4K2API4KB
SCHEMBL31001565 0.82 P2RX3 (0.49) RXFP1PI4KAPI4K2BPI4K2API4KB
SCHEMBL30239335 0.80 DOT1L (0.50) RXFP1PI4KAPI4K2BPI4K2API4KB
SCHEMBL26530697 0.79 PI4KA (0.55) RXFP1PI4KAPI4K2BPI4K2API4KB

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-20250093263-A1 FRET-BASED ASSAYS THE GENERAL HOSPITAL CORPORATION 2025-03-20 — — 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-20250093263-A1 FRET-BASED ASSAYS TARBP1, GTPBP4, TERF2IP RXFP1 2124/4885PI4KA 2154/4885PI4K2B 2299/4885

“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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