SCHEMBL8917316

SCHEMBL8917316

C=C(C=C(C)C(=O)O)C(=O)OCCCC.O=S(=O)(O)C=Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 3/20 0.41
PPARG P37231 2/20 0.39
POLB P06746 2/20 0.38
GAA P10253 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TSHR P16473 4/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
EGFR P00533 1/20 0.36
BCHE P06276 3/20 0.35
ACHE P22303 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL7213090 0.88 KDM4E (0.42) KDM4ETDP1PPARGPOLBGAA
Styrene SCHEMBL1085643 0.87 KDM4E (0.41) KDM4ETDP1POLBMEN1KMT2A
SCHEMBL12490541 0.85 KDM4E (0.57) KDM4ETDP1POLBGAAMEN1
Styrene SCHEMBL251772 0.84 KDM4E (0.45) KDM4ETDP1POLBMEN1KMT2A
SCHEMBL9701897 0.83 KDM4E (0.45) KDM4ETDP1POLBMEN1KMT2A
Styrene SCHEMBL4627611 0.81 KDM4E (0.43) KDM4ETDP1POLBMEN1KMT2A
SCHEMBL9065918 0.81 KDM4E (0.53) KDM4ETDP1POLBGAAMEN1
Methacrylic Acid SCHEMBL8917320 0.81 TSHR (0.49) KDM4ETDP1PPARGGAAMEN1
Oxirane SCHEMBL51272 0.81 KDM4E (0.53) KDM4ETDP1POLBGAAMEN1
SCHEMBL10867479 0.81 KDM4E (0.45) KDM4ETDP1POLBGAAMEN1

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-5604083-A BLEND OF ELECTROCONDUCTIVE POLYMER AND OXAZOLINE POLYMER MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-02-18 US disclosed
US-5238706-A Photographic substrate coated with antistatic agent and crosslinking agent is rolled and heated to cure MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-08-24 US disclosed