SCHEMBL4459514

SCHEMBL4459514

CCCCOC(=O)CN(c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.51
L3MBTL1 Q9Y468 5/20 0.51
TDP1 Q9NUW8 3/20 0.51
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 6/20 0.47
MAPK1 P28482 4/20 0.47
CYP3A4 P08684 2/20 0.47
TP53 P04637 1/20 0.46
HSD17B10 Q99714 2/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
LTA4H P09960 2/20 0.43
POLB P06746 1/20 0.43
ALOX15 P16050 1/20 0.43
KDM4E B2RXH2 2/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL4460270 0.90 LMNA (0.51) TSHRTDP1ALDH1A1TP53HSD17B10
SCHEMBL10525505 0.87 TSHR (0.51) TSHRL3MBTL1TDP1MEN1KMT2A
SCHEMBL11045012 0.83 TSHR (0.47) TSHRL3MBTL1TDP1MEN1KMT2A
SCHEMBL4458579 0.83 SMN1; SMN2 (0.57) TSHRMEN1KMT2AALDH1A1TP53
SCHEMBL13541178 0.78 TSHR (0.51) TSHRL3MBTL1TDP1MEN1KMT2A
SCHEMBL13611308 0.78 PLA2G2A (0.60) TSHRALDH1A1MAPK1CYP3A4TP53
SCHEMBL28109935 0.77 TSHR (0.47) TSHRL3MBTL1TDP1MEN1KMT2A
SCHEMBL11458539 0.76 SMN1; SMN2 (0.47) TSHRL3MBTL1TDP1MEN1KMT2A
SCHEMBL7437555 0.75 MTNR1A (0.49) TSHRALDH1A1MAPK1LMNAPOLB
SCHEMBL8761336 0.75 CHRNB2 (0.61) TSHRL3MBTL1TDP1MEN1KMT2A

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-20090189127-A1 Optical resin lens and production method for optical resin material KONICA MINOLTA OTPO, INC. (JP) 2009-07-30 US disclosed
CN-1910477-A Optical resin lens and method for producing optical resin material KONICA MINOLTA OPTO INC (JP) 2007-02-07 CN disclosed
EP-1717607-A1 OPTICAL RESIN LENS AND METHOD FOR PRODUCING OPTICAL RESIN MATERIAL Konica Minolta Opto, Inc. (JP) 2006-11-02 EP disclosed
US-4507450-A COORDINATION CATALYSTS MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1985-03-26 US disclosed
US-4229558-A HAVING HIGH ISOTACTIC INDEX BY USING A CATALYST PREPARED FROM A MAGNESIUM GRIGNARD REAGENT, TITANIUM HALIDE AN ETHER AND A CARBOXYLIC ESTER COMBINED WITH AN ORGANOALUMINUM COMPOUND MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1980-10-21 US disclosed