SCHEMBL9364258

SCHEMBL9364258

CC(C)(C)c1cc(C(=O)OCc2ccc(C(=O)OC(=O)c3ccccc3)cc2)cc(C(C)(C)C)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
TDP1 Q9NUW8 2/20 0.54
SLC6A2 P23975 1/20 0.54
SLC6A3 Q01959 1/20 0.54
LMNA P02545 1/20 0.54
MEN1 O00255 1/20 0.50
RAB9A P51151 3/20 0.49
NPC1 O15118 1/20 0.49
MAPT P10636 4/20 0.48
ALDH1A1 P00352 2/20 0.48
HPGD P15428 2/20 0.48
GAA P10253 1/20 0.47
RXRA P19793 1/20 0.45
RXRB P28702 1/20 0.45
RXRG P48443 1/20 0.45
PTGS2 P35354 2/20 0.45
TNFRSF1A P19438 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTT P42858 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL8875455 0.94 LMNA (0.61) KMT2ATDP1SLC6A2SLC6A3LMNA
Benzoic Acid SCHEMBL9364247 0.91 RXRA (0.55) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL11608103 0.90 KMT2A (0.58) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL5080279 0.87 RXRA (0.52) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL12003778 0.87 KMT2A (0.58) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL4392699 0.87 TNFRSF1A (0.54) KMT2ATDP1LMNAMEN1MAPT
SCHEMBL29213573 0.85 TNFRSF1A (0.52) KMT2ATDP1LMNAMEN1MAPT
Butylated Hydroxytoluene SCHEMBL16652654 0.85 TDP1 (0.60) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL28893866 0.84 KMT2A (0.55) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL11607589 0.83 MEN1 (0.49) KMT2ALMNAMEN1RAB9ANPC1

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
EP-0465343-B1 Pharmaceutical or cosmetical composition comprising a retinoid and a sterol in association CIRD GALDERMA (FR) 1994-06-15 EP claimed