SCHEMBL30032122

SCHEMBL30032122

COC(=O)c1cc2c(n(Cc3ccc(OC)cc3OC)c1=O)-c1nc3c(OC(F)F)cc(OC)cn3c1C[C@H]2C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AADAT Q8N5Z0 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ TACR1 P25103 1/20 0.32
▸ BTK Q06187 1/20 0.32
▸ GHSR Q92847 2/20 0.32
▸ KLKB1 P03952 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ TP53 P04637 2/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31
▸ PDE9A O76083 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ PDE4B Q07343 1/20 0.31

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
SCHEMBL30032226 1.00 AADAT (0.33) AADATMAPTTACR1BTKGHSR
SCHEMBL30031487 1.00 AADAT (0.33) AADATMAPTTACR1BTKGHSR
SCHEMBL30031916 0.98 AADAT (0.33) AADATMAPTTACR1BTKGHSR
SCHEMBL30031253 0.96 AADAT (0.33) AADATMAPTTACR1BTKGHSR
SCHEMBL30030872 0.95 MAPT (0.34) AADATMAPTTACR1BTKGHSR
SCHEMBL30031821 0.94 AADAT (0.34) AADATMAPTTACR1TP53MEN1
SCHEMBL30031819 0.94 AADAT (0.34) AADATMAPTTACR1TP53MEN1
SCHEMBL30031425 0.94 AADAT (0.34) AADATMAPTTACR1TP53MEN1
SCHEMBL30031479 0.94 AADAT (0.35) AADATMAPTBTKLMNATP53
SCHEMBL30032175 0.92 AADAT (0.34) AADATMAPTTACR1TP53MEN1

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-2022214937-A1 SUBSTITUTED TETRACYCLIC CARBOXYLIC ACIDS, ANALOGUES THEREOF, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2022-10-13 — — WO disclosed
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