SCHEMBL16788679

SCHEMBL16788679

C[Si](C)(C)c1ccc(-n2c3cc(-c4ccc5ccc6cccc7ccc4c5c67)cc4ccc5cc(-c6ccc7ccc8cccc9ccc6c7c89)cc2c5c43)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ERBB2 P04626 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ FYN P06241 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ AHR P35869 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPT P10636 1/20 0.30

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
SCHEMBL16788690 0.91 ERBB2 (0.32) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL16788671 0.88 CYP1A1 (0.32) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL16788669 0.86 ALDH1A1 (0.38) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL16788722 0.86 ALDH1A1 (0.31) CYP1A2ALDH1A1HPGDCYP3A4TSHR
SCHEMBL16788699 0.86 ERBB2 (0.30) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL16788684 0.86 CYP1A2 (0.42) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL16788677 0.84 CYP1A2 (0.42) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL16788681 0.84 CYP1A2 (0.40) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL16788702 0.83 ALDH1A1 (0.37) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL16788678 0.83 ERBB2 (0.34) ERBB2CYP1A2FYNMAOAACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9553271-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-01-24 — — US disclosed
US-9553271-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-01-24 — — US disclosed
US-20150162540-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-11 — — US disclosed
US-20150162540-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-11 — — US disclosed
Send feedback