SCHEMBL4555824

SCHEMBL4555824

C=C[CH]OC(C=C)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.33
KDM4E B2RXH2 4/20 0.33
MAPT P10636 4/20 0.33
ALOX15 P16050 4/20 0.33
CYP2C19 P33261 1/20 0.32
HPGD P15428 3/20 0.32
USP2 O75604 2/20 0.32
TP53 P04637 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
ALOX12 P18054 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
MTOR P42345 1/20 0.31
RAB9A P51151 1/20 0.31
GRM7 Q14831 1/20 0.31
TSHR P16473 3/20 0.31
DPP4 P27487 2/20 0.31

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
SCHEMBL17616783 0.83 CYP2C19 (0.34) CYP3A4KDM4EMAPTALOX15CYP2C19
SCHEMBL11211725 0.79 CYP2D6 (0.37) CYP3A4KDM4EMAPTALOX15CYP2C19
SCHEMBL3802806 0.78 CYP2C19 (0.36) CYP3A4KDM4EMAPTALOX15CYP2C19
SCHEMBL252297 0.78 CYP3A4 (0.37) CYP3A4KDM4EMAPTALOX15CYP2C19
SCHEMBL2488648 0.78 CYP2C19 (0.36) CYP3A4KDM4EMAPTALOX15CYP2C19
SCHEMBL2950286 0.76 CYP2C19 (0.35) CYP3A4KDM4EMAPTALOX15CYP2C19
SCHEMBL194133 0.74 KDM4E (0.40) CYP3A4KDM4EMAPTALOX15CYP2C19
SCHEMBL2463795 0.74 CYP2C19 (0.38) CYP3A4KDM4EMAPTALOX15CYP2C19
SCHEMBL4865335 0.74 SRD5A2 (0.42) CYP3A4KDM4EMAPTALOX15CYP2C19
SCHEMBL3291158 0.74 SLC6A4 (0.39) CYP3A4KDM4EMAPTALOX15CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2122020-A1 WETTABLE POLYESTER FIBERS AND FABRICS Ciba Holding Inc. (CH) 2009-11-25 EP claimed
WO-2008090060-A1 WETTABLE POLYESTER FIBERS AND FABRICS CIBA HOLDING INC. (CH) 2008-07-31 WO claimed
US-20080176475-A1 Wettable polyester fibers and fabrics CIBA CORP. 2008-07-24 US claimed
EP-2122020-A1 WETTABLE POLYESTER FIBERS AND FABRICS Ciba Holding Inc. (CH) 2009-11-25 EP disclosed
EP-2122020-A1 WETTABLE POLYESTER FIBERS AND FABRICS Ciba Holding Inc. (CH) 2009-11-25 EP disclosed
WO-2008090060-A1 WETTABLE POLYESTER FIBERS AND FABRICS CIBA HOLDING INC. (CH) 2008-07-31 WO disclosed
WO-2008090060-A1 WETTABLE POLYESTER FIBERS AND FABRICS CIBA HOLDING INC. (CH) 2008-07-31 WO disclosed
US-20080176475-A1 Wettable polyester fibers and fabrics CIBA CORP. 2008-07-24 US disclosed
US-20080176475-A1 Wettable polyester fibers and fabrics CIBA CORP. 2008-07-24 US disclosed