SCHEMBL31146870

SCHEMBL31146870

C=CCNc1cc2c(cc1I)OC(F)(F)O2

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GAA P10253 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
SCHEMBL31146894 0.78 CYP1A2 (0.40) GAA
SCHEMBL31146892 0.67
SCHEMBL16044114 0.64 GPR3 (0.34)
SCHEMBL3222871 0.64 LMNA (0.36) GAA
SCHEMBL31457665 0.63 AHR (0.33)
SCHEMBL1859168 0.63 GPR3 (0.33)
SCHEMBL23505678 0.62 TSHR (0.40)
SCHEMBL2321410 0.61 ALDH1A1 (0.39) GAA
SCHEMBL7698498 0.60 CYP3A4 (0.54) GAA
SCHEMBL24793421 0.60 TSHR (0.41) GAA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4680606-A1 ADENINE DERIVATIVES AS HSP90 INHIBITORS AtmosR (FR) 2026-01-21 EP disclosed
WO-2024194175-A1 ADENINE DERIVATIVES AS HSP90 INHIBITORS ATMOSR (FR) 2024-09-26 WO disclosed