SCHEMBL17935585

SCHEMBL17935585

C[Si](C)(C)c1ccc2c(-c3ccc(-c4ccccc4)cc3)c3ccccc3c(-c3cccc4ccccc34)c2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ ATM Q13315 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ SLC6A9 P48067 1/20 0.38
▸ ENPP1 P22413 2/20 0.38
▸ ENPP3 O14638 1/20 0.38
▸ CA12 O43570 2/20 0.37
▸ CA1 P00915 2/20 0.37

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
SCHEMBL126429 1.00 ALDH1A1 (0.40) ALDH1A1KDM4EATMHSD17B10MAPT
SCHEMBL126261 1.00 ALDH1A1 (0.40) ALDH1A1KDM4EATMHSD17B10MAPT
SCHEMBL12023379 0.97 ALDH1A1 (0.42) ALDH1A1KDM4EATMHSD17B10MAPT
SCHEMBL16352619 0.97 ALDH1A1 (0.42) ALDH1A1KDM4EATMHSD17B10MAPT
SCHEMBL16352625 0.97 ALDH1A1 (0.42) ALDH1A1KDM4EATMHSD17B10MAPT
SCHEMBL17934708 0.93 ENPP1 (0.45) ALDH1A1KDM4EATMHSD17B10MAPT
SCHEMBL17935584 0.93 ENPP1 (0.45) ALDH1A1KDM4EATMHSD17B10MAPT
SCHEMBL26761119 0.92 ENPP1 (0.43) ALDH1A1KDM4EATMHSD17B10MAPT
SCHEMBL23789788 0.91 CA12 (0.43) ALDH1A1KDM4EATMHSD17B10MAPT
SCHEMBL4084177 0.90 DHFR (0.43) ALDH1A1KDM4EATMHSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160211459-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-21 — — US disclosed
US-20160211458-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-07-21 — — US disclosed
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