SCHEMBL5135534

SCHEMBL5135534

O=C(O)C=Cc1cccc(OC(=O)CCCCC(=O)Oc2cccc(C=CC(=O)O)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.61
▸ ALDH1A1 P00352 2/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.61
▸ PKM P14618 1/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.50
▸ AKR1C3 P42330 8/20 0.48
▸ AKR1C2 P52895 2/20 0.48
▸ HDAC3 O15379 1/20 0.47
▸ TNKS O95271 1/20 0.47
▸ HDAC4 P56524 1/20 0.47
▸ HDAC1 Q13547 1/20 0.47
▸ HCAR2 Q8TDS4 1/20 0.47
▸ HDAC7 Q8WUI4 1/20 0.47
▸ HDAC2 Q92769 1/20 0.47
▸ HDAC10 Q969S8 1/20 0.47
▸ HDAC11 Q96DB2 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ TNKS2 Q9H2K2 1/20 0.47
▸ HDAC6 Q9UBN7 1/20 0.47
▸ HDAC9 Q9UKV0 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
SCHEMBL5135532 1.00 KDM4E (0.61) KDM4EALDH1A1SMN1; SMN2PKMNPSR1
SCHEMBL20788032 0.92 ALDH1A1 (0.60) KDM4EALDH1A1SMN1; SMN2PKMAKR1C3
SCHEMBL20788033 0.92 ALDH1A1 (0.60) KDM4EALDH1A1SMN1; SMN2PKMAKR1C3
SCHEMBL3616763 0.89 KDM4E (0.66) KDM4EALDH1A1SMN1; SMN2PKMNPSR1
SCHEMBL3616760 0.89 KDM4E (0.66) KDM4EALDH1A1SMN1; SMN2PKMNPSR1
SCHEMBL14508502 0.88 KDM4E (0.64) KDM4EALDH1A1SMN1; SMN2PKMNPSR1
SCHEMBL20788020 0.85 ALDH1A1 (0.52) KDM4EALDH1A1SMN1; SMN2PKMAKR1C3
SCHEMBL20788019 0.85 ALDH1A1 (0.52) KDM4EALDH1A1SMN1; SMN2PKMAKR1C3
SCHEMBL27455901 0.82 AKR1C3 (0.64) KDM4EALDH1A1SMN1; SMN2PKMAKR1C3
SCHEMBL3169519 0.81 KMT2A (0.65) KDM4EPKMAKR1C3AKR1C2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1948203-A2 AROMATIC DI-ACID-CONTAINING POLY (ESTER AMIDE) POLYMERS AND METHODS OF USE Medivas, LLC (US) 2008-07-30 — — EP claimed
US-20070106035-A1 Aromatic di-acid-containing poly (ester amide) polymers and methods of use MEDIVAS, LLC (US) 2007-05-10 — — US claimed
WO-2007050583-A2 AROMATIC DI-ACID-CONTAINING POLY (ESTER AMIDE) POLYMERS AND METHODS OF USE MEDIVAS, LLC (US) 2007-05-03 — — WO claimed
EP-1948203-A2 AROMATIC DI-ACID-CONTAINING POLY (ESTER AMIDE) POLYMERS AND METHODS OF USE Medivas, LLC (US) 2008-07-30 — — EP disclosed
US-20070106035-A1 Aromatic di-acid-containing poly (ester amide) polymers and methods of use MEDIVAS, LLC (US) 2007-05-10 — — US disclosed
WO-2007050583-A2 AROMATIC DI-ACID-CONTAINING POLY (ESTER AMIDE) POLYMERS AND METHODS OF USE MEDIVAS, LLC (US) 2007-05-03 — — WO disclosed
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