SCHEMBL9724817

SCHEMBL9724817

CCC(C)CC(=O)Oc1ccc(O)cc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ELANE P08246 4/20 0.61
ESR1 P03372 2/20 0.47
HIF1A Q16665 2/20 0.47
FFAR1 O14842 1/20 0.42
KMT2A Q03164 3/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAPT P10636 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MIF P14174 1/20 0.39
LTA4H P09960 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL9724815 1.00 ELANE (0.61) ELANEESR1HIF1AFFAR1KMT2A
SCHEMBL10358648 0.95 ELANE (0.57) ELANEESR1HIF1AFFAR1KMT2A
SCHEMBL6937874 0.95 ELANE (0.57) ELANEESR1HIF1AFFAR1KMT2A
SCHEMBL27581241 0.84 ELANE (0.59) ELANEESR1HIF1AFFAR1KMT2A
SCHEMBL9149495 0.83 KMT2A (0.47) ELANEESR1HIF1AFFAR1KMT2A
SCHEMBL10421858 0.83 ELANE (0.58) ELANEESR1HIF1AFFAR1KMT2A
SCHEMBL9149502 0.83 KMT2A (0.47) ELANEESR1HIF1AFFAR1KMT2A
SCHEMBL9724797 0.82 ELANE (0.57) ELANEESR1HIF1AFFAR1KMT2A
SCHEMBL9724830 0.82 ELANE (0.57) ELANEESR1HIF1AFFAR1KMT2A
SCHEMBL10422483 0.82 ELANE (0.57) ELANEESR1HIF1AFFAR1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5100579-A POLYPHENYL-BASED ESTER COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME AJINOMOTO CO., INC. (JP) 1992-03-31 US disclosed
EP-0191600-B1 POLYPHENYL-BASED ESTER COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME AJINOMOTO CO., INC. (JP) 1991-12-27 EP disclosed
US-4728458-A FERROELECTRIC AJINOMOTO CO., LTD. (JP) 1988-03-01 US disclosed
EP-0191600-A2 Polyphenyl-based ester compounds and liquid crystal compositions containing same AJINOMOTO CO., INC. (JP) 1986-08-20 EP disclosed