SCHEMBL18151691

SCHEMBL18151691

C=C(C=Cc1ccccc1)C(=O)OCC.C=CC(=O)OCCCC

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.51
HPGD P15428 1/20 0.51
APP P05067 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.43
AKR1B10 O60218 2/20 0.43
AKR1B1 P15121 2/20 0.43
THRB P10828 1/20 0.42
BCHE P06276 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
RAB9A P51151 1/20 0.41
ACHE P22303 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
EGFR P00533 1/20 0.41
HDAC3 O15379 1/20 0.41

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
Acrylic Acid Ethyl Ester SCHEMBL5153322 0.95 TSHR (0.48) TSHRHPGDAPPTDP1MEN1
SCHEMBL10906553 0.91 TSHR (0.49) TSHRHPGDAPPTDP1MEN1
SCHEMBL11598347 0.91 TSHR (0.49) TSHRHPGDAPPTDP1MEN1
SCHEMBL5072653 0.91 TSHR (0.51) TSHRHPGDAPPTDP1MEN1
SCHEMBL17746668 0.89 TSHR (0.55) TSHRHPGDAPPTDP1KDM4E
SCHEMBL4809271 0.89 TSHR (0.42) TSHRHPGDAPPTDP1MEN1
Acrylic Acid Ethyl Ester SCHEMBL11604011 0.88 TDP1 (0.43) TSHRHPGDAPPTDP1KDM4E
Acrylic Acid Methyl Ester SCHEMBL10706577 0.88 KDM4E (0.48) TSHRHPGDAPPTDP1MEN1
SCHEMBL10906047 0.88 KDM4E (0.47) TSHRAPPTDP1MEN1KMT2A
Acrylic Acid SCHEMBL29184857 0.88 KDM4E (0.49) TSHRHPGDAPPTDP1KDM4E

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
US-9765210-B2 Thermoplastic resin composition and molded article produced therefrom LOTTE ADVANCED MATERIALS CO., LTD. (KR) 2017-09-19 US disclosed
US-20160304711-A1 Thermoplastic Resin Composition and Molded Article Produced Therefrom LOTTE ADVANCED MATERIALS CO., LTD. (KR) 2016-10-20 US disclosed