SCHEMBL6031349

SCHEMBL6031349

CCC(=O)Oc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.69
SMN1; SMN2 Q16637 4/20 0.59
KMT2A Q03164 3/20 0.59
ESR1 P03372 2/20 0.59
HIF1A Q16665 2/20 0.59
RECQL P46063 1/20 0.59
LTA4H P09960 2/20 0.52
ACHE P22303 1/20 0.51
RAB9A P51151 3/20 0.51
HTT P42858 2/20 0.51
LMNA P02545 1/20 0.51
MAPT P10636 3/20 0.50
NPC1 O15118 2/20 0.50
HPGD P15428 2/20 0.50
NFKB1 P19838 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
TP53 P04637 1/20 0.49

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
SCHEMBL9799566 0.92 ELANE (0.72) ELANESMN1; SMN2KMT2AESR1HIF1A
SCHEMBL6282777 0.92 KMT2A (0.68) ELANESMN1; SMN2KMT2AESR1HIF1A
SCHEMBL45119 0.92 ELANE (0.72) ELANESMN1; SMN2KMT2AESR1HIF1A
Benzene SCHEMBL28089483 0.92 ELANE (0.72) ELANESMN1; SMN2KMT2AESR1HIF1A
SCHEMBL31575762 0.90 ELANE (0.70) ELANESMN1; SMN2KMT2AESR1HIF1A
SCHEMBL17028724 0.90 ELANE (0.70) ELANESMN1; SMN2KMT2AESR1HIF1A
SCHEMBL376108 0.90 ELANE (0.70) ELANESMN1; SMN2KMT2AESR1HIF1A
Ammonia Solution, Strong SCHEMBL22042017 0.90 ELANE (0.70) ELANESMN1; SMN2KMT2AESR1HIF1A
Magnesium SCHEMBL31307540 0.90 ELANE (0.70) ELANESMN1; SMN2KMT2AESR1HIF1A
Methane SCHEMBL6301524 0.90 ELANE (0.70) ELANESMN1; SMN2KMT2AESR1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101909451-A Fungicidal mixtures II BASF SE 2010-12-08 CN claimed
CN-107207421-A New trifluoromethyl propanamide derivative 豪夫迈·罗氏有限公司 2017-09-26 CN disclosed
CN-101909451-A Fungicidal mixtures II BASF SE 2010-12-08 CN disclosed
EP-1652833-A1 PROCESS FOR PRODUCING 4-HYDROXYDIPHENYL ETHER Sumitomo Chemical Company, Limited (JP) 2006-05-03 EP disclosed
CN-1147481-C Pyrimidine-2,4,6-triones as inhibitors of matrix metalloproteinases - 2004-04-28 CN disclosed
CN-1339028-A Pyrimidine-2,4,6-triones as inhibitors of matrix metalloproteinases HOFFMANN LA ROCHE (CH) 2002-03-06 CN disclosed
EP-0384230-A1 Substituted phenoxyphenyl propionic acid derivatives BAYER AG (DE) 1990-08-29 EP disclosed
US-3985779-A ANTIINFLAMMATORY AND ANALGESIC ACTIVITIES EISAI CO., LTD. (JA) 1976-10-12 US disclosed