SCHEMBL7526199

SCHEMBL7526199

CC(C)(C)c1ccc2c(Br)cc(C(C)(C)C)cc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.42
KIF11 P52732 3/20 0.39
ALDH1A1 P00352 7/20 0.39
ALOX15 P16050 4/20 0.39
HSD17B10 Q99714 3/20 0.39
HPGD P15428 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
HIF1A Q16665 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
MAPT P10636 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
RECQL P46063 2/20 0.35
GAA P10253 2/20 0.35
PKM P14618 2/20 0.35
ALOX12 P18054 2/20 0.35
TSHR P16473 2/20 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
SCHEMBL27227586 0.85 NR1I2 (0.39) NR1I2KIF11ALDH1A1ALOX15HSD17B10
SCHEMBL7950730 0.78 NR1I2 (0.45) NR1I2KIF11ALDH1A1ALOX15HSD17B10
SCHEMBL4151318 0.77 HIF1A (0.42) KIF11ALDH1A1ALOX15HSD17B10HPGD
SCHEMBL243599 0.76 NR1I2 (0.34) NR1I2KIF11HIF1ACYP1A2CYP2D6
SCHEMBL30931254 0.76 ALDH1A1 (0.43) NR1I2KIF11ALDH1A1ALOX15HSD17B10
SCHEMBL11438490 0.76 ALDH1A1 (0.43) NR1I2KIF11ALDH1A1ALOX15HSD17B10
SCHEMBL18365182 0.75 ALDH1A1 (0.53) NR1I2KIF11ALDH1A1ALOX15HSD17B10
SCHEMBL29816195 0.75 ALDH1A1 (0.46) KIF11ALDH1A1ALOX15HSD17B10HPGD
SCHEMBL1134714 0.75 ALDH1A1 (0.46) KIF11ALDH1A1ALOX15HSD17B10HPGD
SCHEMBL2253646 0.75 NR1I2 (0.46) NR1I2KIF11ALDH1A1ALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0851715-B1 Organic electroluminescent devices and luminescent display employing such organic electroluminescent devices SONY CORP (JP) 2002-03-13 EP disclosed
US-5858564-A Organic electroluminescent devices and luminescent display employing such organic electroluminescent devices SONY CORPORATION (JP) 1999-01-12 US disclosed
EP-0851715-A1 Organic electroluminescent devices and luminescent display employing such organic electroluminescent devices SONY CORPORATION (JP) 1998-07-01 EP disclosed