SCHEMBL26627273

SCHEMBL26627273

O=C(O)c1ccc(C2=CCC(C(=O)O)(c3cccc(-c4ccccc4)c3-c3ccccc3)C=C2)cc1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RARB P10826 7/20 0.38
RARG P13631 7/20 0.38
RARA P10276 6/20 0.38
RXRA P19793 3/20 0.38
NR2E1 Q9Y466 1/20 0.38
TTR P02766 1/20 0.35
PDK2 Q15119 4/20 0.35
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
TRIM24 O15164 1/20 0.33
TRIM33 Q9UPN9 1/20 0.33
HNF4A P41235 1/20 0.33
MAP4K4 O95819 1/20 0.32
FOLH1 Q04609 1/20 0.32
EGFR P00533 1/20 0.32

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
SCHEMBL30159269 0.80 RARA (0.37) RARBRARGRARARXRANR2E1
SCHEMBL9199935 0.80 EGFR (0.36) RARBRARGRARARXRANR2E1
SCHEMBL18259088 0.74 NPC1 (0.38) RARBTRIM24TRIM33MAP4K4EGFR
SCHEMBL27042598 0.72 HDAC4 (0.37)
SCHEMBL29515981 0.72 THRB (0.39) RARBRARGRARARXRANR2E1
SCHEMBL28333533 0.72 RXRA (0.45) RARBRARGRARARXRANR2E1
SCHEMBL22325605 0.71 POLB (0.32) HNF4A
SCHEMBL27036929 0.71 POLB (0.32) HNF4A
SCHEMBL30589358 0.70 GAA (0.36) RARBRARGRXRATTRGAA
SCHEMBL28731530 0.70 RXRA (0.45) RARBRARGRXRAPDK2RXRB

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-2023209342-A1 METHOD AND APPARATUS FOR CARBON DIOXIDE SEPARATION MOF Technologies Limited (GB) 2023-11-02 WO disclosed