SCHEMBL3933447

SCHEMBL3933447

O=C(O)CCC=C(Cc1ccco1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.45
CYP2C19 P33261 1/20 0.45
ALDH1A1 P00352 9/20 0.41
KDM4E B2RXH2 8/20 0.41
HSD17B10 Q99714 8/20 0.41
MAPT P10636 8/20 0.41
PKM P14618 1/20 0.41
POLB P06746 7/20 0.38
HPGD P15428 3/20 0.38
USP2 O75604 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPK1 P28482 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
ATM Q13315 1/20 0.37
ALOX5 P09917 1/20 0.36
PTPN7 P35236 1/20 0.36
RAB9A P51151 1/20 0.35

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
SCHEMBL30911299 0.84 TSHR (0.46) TSHRCYP2C19ALDH1A1KDM4EHSD17B10
SCHEMBL8074231 0.81 TSHR (0.44) TSHRCYP2C19ALDH1A1KDM4EMAPT
SCHEMBL15567587 0.81 TSHR (0.44) TSHRCYP2C19ALDH1A1KDM4EMAPT
SCHEMBL11791942 0.80 EP300 (0.44) TSHRCYP2C19ALDH1A1KDM4EHSD17B10
SCHEMBL11791621 0.80 EP300 (0.44) TSHRCYP2C19ALDH1A1KDM4EHSD17B10
SCHEMBL11791619 0.80 EP300 (0.44) TSHRCYP2C19ALDH1A1KDM4EHSD17B10
SCHEMBL11791945 0.80 EP300 (0.44) TSHRCYP2C19ALDH1A1KDM4EHSD17B10
SCHEMBL27859085 0.78 TSHR (0.46) TSHRCYP2C19ALDH1A1KDM4EHSD17B10
SCHEMBL10902357 0.75 TSHR (0.69) TSHRCYP2C19ALDH1A1KDM4EMAPT
SCHEMBL9238675 0.75 TSHR (0.44) TSHRCYP2C19ALDH1A1KDM4EHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7544743-B2 Process of controlled radical grafting of a polyolefin UNIVERSITA' DI PISA (IT) 2009-06-09 US disclosed
EP-1641838-B1 A PROCESS OF CONTROLLED RADICAL GRAFTING OF A POLYOLEFIN UNIV PISA (IT) 2008-06-11 EP disclosed
US-20060148993-A1 Process of controlled radical grafting of a polyolefin UNIVERSITA' DI PISA (IT) 2006-07-06 US disclosed
EP-1641838-A2 A PROCESS OF CONTROLLED RADICAL GRAFTING OF A POLYOLEFIN UNIVERSITA' DI PISA (IT) 2006-04-05 EP disclosed
WO-2004113399-A2 A PROCESS OF CONTROLLED RADICAL GRAFTING OF A POLYOLEFIN UNIVERSITA' DI PISA (IT) 2004-12-29 WO disclosed