SCHEMBL26516646

SCHEMBL26516646

C=CC(=O)N(F)c1ccc(C)c(CCC)c1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 4/20 0.35
▸ BCL2A1 Q16548 1/20 0.34
▸ PSMB5 P28074 3/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ XBP1 P17861 1/20 0.32
▸ HIF1A Q16665 1/20 0.32
▸ THRA P10827 2/20 0.31
▸ SHBG P04278 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
SCHEMBL20171863 0.71 IGLV6-57 (0.40) HIF1A
SCHEMBL14981814 0.71 TAAR1 (0.44) —
SCHEMBL26805113 0.70 TAAR1 (0.38) —
SCHEMBL3049598 0.69 NPSR1 (0.38) LMNAMAPT
SCHEMBL14402810 0.68 THRB (0.41) THRBMAPTHIF1ATHRA
SCHEMBL13968315 0.68 THRB (0.50) THRBTHRA
SCHEMBL172562 0.68 THRB (0.50) THRBTHRA
SCHEMBL13878905 0.67 TAAR1 (0.41) LMNAMAPT
SCHEMBL15325843 0.66 F2RL1 (0.41) LMNAMAPTXBP1HIF1A
SCHEMBL24071971 0.65 TP53 (0.39) THRBMAPT

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-2023194310-A1 THERAPEUTIC COMBINATION OF KRAS G12C INHIBITOR AND TEAD INHIBITOR SANOFI (FR) 2023-10-12 — — WO disclosed
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