SCHEMBL5646820

SCHEMBL5646820

CCOC(=O)c1c2c(c3cccc4c3c1-c1ccccc1-4)OC(c1ccc(OC)cc1)(c1ccc(N3CCOCC3)cc1)C=C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.41
SOAT1 P35610 3/20 0.41
MAPT P10636 7/20 0.40
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NPSR1 Q6W5P4 3/20 0.40
LMNA P02545 3/20 0.40
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GAA P10253 2/20 0.36
TP53 P04637 1/20 0.36
THRB P10828 1/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MRGPRX4 Q96LA9 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
SCHEMBL5646444 0.91 MAP3K5 (0.39) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL29565421 0.85 MAPT (0.43) DGAT1SOAT1MAPTALDH1A1MEN1
SCHEMBL4598178 0.85 MAPT (0.43) DGAT1SOAT1MAPTALDH1A1MEN1
SCHEMBL5646123 0.83 MAP3K5 (0.41) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL3830804 0.80 ALDH1A1 (0.42) DGAT1SOAT1MAPTALDH1A1MEN1
SCHEMBL3822262 0.79 ALDH1A1 (0.40) DGAT1SOAT1MAPTALDH1A1MEN1
SCHEMBL26808258 0.76 KMT2A (0.33) MAPTALDH1A1MEN1KMT2ANPSR1
SCHEMBL8919915 0.76 MEN1 (0.38) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL5650561 0.76 TP53 (0.37) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL26808079 0.76 KDM4E (0.33) MAPTALDH1A1MEN1KMT2ALMNA

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
US-7166357-B2 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL, INC. (US) 2007-01-23 US claimed
US-20040185268-A1 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL LIMITED (IE) 2004-09-23 US claimed
US-5891368-A PHOTOCHROMIC COMPOUNDS AND COATINGS WITH COMPOUNDS PPG INDUSTRIES, INC. (US) 1999-04-06 US claimed
US-7166357-B2 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL, INC. (US) 2007-01-23 US disclosed
US-20040185268-A1 Photochromic articles that activate behind ultraviolet radiation blocking transparencies and methods for preparation TRANSITIONS OPTICAL LIMITED (IE) 2004-09-23 US disclosed
US-5891368-A PHOTOCHROMIC COMPOUNDS AND COATINGS WITH COMPOUNDS PPG INDUSTRIES, INC. (US) 1999-04-06 US disclosed