SCHEMBL6242526

SCHEMBL6242526

CC(=O)Oc1ccc(-c2ccc3ccccc3c2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.59
GAA P10253 2/20 0.59
MAPT P10636 2/20 0.59
TDP1 Q9NUW8 1/20 0.59
HSD17B10 Q99714 1/20 0.56
POLB P06746 2/20 0.56
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
ESR1 P03372 1/20 0.53
ESR2 Q92731 1/20 0.53
ELANE P08246 1/20 0.53
ALDH1A1 P00352 1/20 0.50
HSP90AA1 P07900 1/20 0.50
HPGD P15428 1/20 0.49
BACE1 P56817 2/20 0.48
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
ACMSD Q8TDX5 1/20 0.47
ALOX5 P09917 1/20 0.47

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
SCHEMBL5048026 0.89 HSD17B10 (0.59) LMNAGAAMAPTTDP1HSD17B10
SCHEMBL25274668 0.87 ESR1 (0.55) LMNAGAAMAPTTDP1HSD17B10
SCHEMBL236488 0.85 ESR1 (0.57) MAPTTDP1HSD17B10MEN1KMT2A
SCHEMBL29672387 0.85 ESR1 (0.57) MAPTTDP1HSD17B10MEN1KMT2A
SCHEMBL237166 0.85 ESR1 (0.57) MAPTTDP1HSD17B10MEN1KMT2A
SCHEMBL30155392 0.85 KMT2A (0.61) LMNAGAAMAPTTDP1HSD17B10
SCHEMBL30439313 0.85 KMT2A (0.61) LMNAGAAMAPTTDP1HSD17B10
SCHEMBL338523 0.85 KMT2A (0.61) LMNAGAAMAPTTDP1HSD17B10
SCHEMBL5045929 0.85 CA12 (0.57) LMNAGAAMAPTTDP1HSD17B10
Hydrochloric Acid SCHEMBL28481470 0.83 KMT2A (0.59) LMNAGAAMAPTTDP1HSD17B10

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005010202-A2 PHENYL ACETIC ACID DERIVATIVES AS HEPATOCYTE NUCLEAR FACTOR 4α (HNF-4α) MODULATOR COMPOUNDS LIGAND PHARMACUETICALS INCORPORATED (US) 2005-02-03 WO claimed
WO-2005010202-A2 PHENYL ACETIC ACID DERIVATIVES AS HEPATOCYTE NUCLEAR FACTOR 4α (HNF-4α) MODULATOR COMPOUNDS LIGAND PHARMACUETICALS INCORPORATED (US) 2005-02-03 WO disclosed