SCHEMBL25393151

SCHEMBL25393151

CC(C)(C)CCc1oc2c(Cl)cccc2c1C(=O)c1cc(I)c(O)c(I)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 8/20 0.55
▸ EYA3 Q99504 5/20 0.53
▸ MEN1 O00255 1/20 0.51
▸ BIRC5 O15392 1/20 0.51
▸ ABCB11 O95342 1/20 0.51
▸ LMNA P02545 1/20 0.51
▸ PGR P06401 1/20 0.51
▸ HTR1A P08908 1/20 0.51
▸ ADRA2A P08913 1/20 0.51
▸ DRD1 P21728 1/20 0.51
▸ TBXA2R P21731 1/20 0.51
▸ PTGS1 P23219 1/20 0.51
▸ SLC6A2 P23975 1/20 0.51
▸ PDE4A P27815 1/20 0.51
▸ ADORA1 P30542 1/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ DRD3 P35462 1/20 0.51
▸ SLC6A3 Q01959 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ HRH3 Q9Y5N1 1/20 0.51

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
SCHEMBL25389481 0.88 TTR (0.53) TTREYA3MEN1ABCB11LMNA
SCHEMBL25391545 0.87 EYA3 (0.70) TTREYA3MEN1BIRC5ABCB11
SCHEMBL30258571 0.86 TTR (0.72) TTREYA3MEN1BIRC5ABCB11
SCHEMBL25387603 0.83 TTR (0.73) TTREYA3MEN1BIRC5ABCB11
SCHEMBL25389746 0.82 EYA3 (0.73) TTREYA3MEN1BIRC5ABCB11
SCHEMBL25391537 0.79 TTR (0.57) TTREYA3MEN1BIRC5ABCB11
SCHEMBL25391820 0.78 EYA3 (0.70) TTREYA3MEN1BIRC5ABCB11
SCHEMBL30258766 0.77 TTR (0.68) TTREYA3MEN1BIRC5ABCB11
SCHEMBL25391802 0.75 EYA3 (0.62) TTREYA3MEN1BIRC5ABCB11
SCHEMBL25391104 0.75 TTR (0.71) TTREYA3MEN1ABCB11LMNA

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-2023149549-A1 NOVEL PHARMACEUTICAL COMPOSITION 国立大学法人富山大学 2023-08-10 — — WO disclosed
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