SCHEMBL31725307

SCHEMBL31725307

O=C(O[C@H]1[C@H](n2cnc3c(N(C(=O)c4ccccc4)C(=O)c4ccccc4)ncnc32)O[C@](F)(CI)[C@H]1F)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.57
▸ P2RX3 P56373 2/20 0.40
▸ P2RX4 Q99571 2/20 0.40
▸ P2RX2 Q9UBL9 2/20 0.40
▸ ENPP1 P22413 1/20 0.38
▸ STING1 Q86WV6 2/20 0.37
▸ P2RX6 O15547 1/20 0.36
▸ P2RX1 P51575 1/20 0.36
▸ P2RX5 Q93086 1/20 0.36
▸ P2RY11 Q96G91 1/20 0.36
▸ P2RX7 Q99572 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA2B P29275 1/20 0.36
▸ NPEPPS P55786 5/20 0.35
▸ ANPEP P15144 4/20 0.35
▸ SLC29A1 Q99808 1/20 0.35
▸ NT5E P21589 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34

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
SCHEMBL31725288 0.93 LMNA (0.58) LMNAP2RX3P2RX4P2RX2ENPP1
SCHEMBL31725276 0.91 LMNA (0.60) LMNAP2RX3P2RX4P2RX2ENPP1
SCHEMBL31725341 0.86 LMNA (0.41) LMNAP2RX3P2RX4P2RX2
SCHEMBL31725285 0.86 LMNA (0.52) LMNAP2RX3P2RX4P2RX2ENPP1
SCHEMBL31725294 0.86 LMNA (0.52) LMNAP2RX3P2RX4P2RX2ENPP1
SCHEMBL31725327 0.82 LMNA (0.53) LMNAP2RX3P2RX4P2RX2ENPP1
SCHEMBL31725325 0.82 LMNA (0.53) LMNAP2RX3P2RX4P2RX2ENPP1
SCHEMBL17445616 0.80 LMNA (0.55) LMNAP2RX3P2RX4P2RX2ENPP1
SCHEMBL17677178 0.80 LMNA (0.64) LMNAP2RX3P2RX4P2RX2ENPP1
SCHEMBL29672348 0.80 LMNA (0.64) LMNAP2RX3P2RX4P2RX2ENPP1

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
WO-2025235664-A1 PURINE NUCLEOTIDE AND NUCLEOSIDE THERAPEUTIC COMPOSITIONS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2025-11-13 — — WO disclosed
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