SCHEMBL7273032

SCHEMBL7273032

O=C(O)CC/C(=C\c1cccc2ccccc12)C(=O)OC(=O)/C(=C/c1cccc2ccccc12)CCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.44
▸ SMPD2 O60906 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ CRHBP P24387 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ CRHR2 Q13324 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ PRNP P04156 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ AKR1B1 P15121 2/20 0.39
▸ FFAR1 O14842 2/20 0.39
▸ MTNR1A P48039 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
SCHEMBL7275461 0.87 KDM4E (0.50) KDM4ESMPD2ALDH1A1TDP1HPGD
SCHEMBL7275466 0.87 KDM4E (0.50) KDM4ESMPD2ALDH1A1TDP1HPGD
SCHEMBL3964497 0.77 KDM4E (0.47) KDM4ESMPD2ALDH1A1TDP1HPGD
SCHEMBL3964492 0.77 KDM4E (0.47) KDM4ESMPD2ALDH1A1TDP1HPGD
SCHEMBL7328215 0.76 KDM4E (0.51) KDM4ESMPD2ALDH1A1TDP1HPGD
SCHEMBL7328223 0.76 KDM4E (0.51) KDM4ESMPD2ALDH1A1TDP1HPGD
SCHEMBL3817099 0.76 KDM4E (0.55) KDM4ESMPD2ALDH1A1TDP1HPGD
SCHEMBL3817101 0.76 KDM4E (0.55) KDM4ESMPD2ALDH1A1TDP1HPGD
SCHEMBL7971777 0.76 KDM4E (0.55) KDM4ESMPD2ALDH1A1TDP1HPGD
SCHEMBL5698294 0.74 KDM4E (0.52) KDM4ESMPD2ALDH1A1TDP1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5378690-A Treatment of angiotensin induced hypertension SANKYO COMPANY, LIMITED (JP) 1995-01-03 — — US disclosed
EP-0274259-B1 New renin-inhibitory oligopeptides, their preparaton and their use SANKYO CO (JP) 1994-02-16 — — EP disclosed
EP-0274259-A2 New renin-inhibitory oligopeptides, their preparaton and their use Sankyo Company Limited (JP) 1988-07-13 — — EP disclosed
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