SCHEMBL17989651

SCHEMBL17989651

CC1(C)c2c(ccc3ccccc23)-c2ccc3c4ccccc4n(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3c21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ DUSP3 P51452 1/20 0.33
▸ MAPT P10636 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ NFKB2 Q00653 1/20 0.33
▸ RELA Q04206 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TUBB4A P04350 1/20 0.32
▸ TUBB P07437 1/20 0.32

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
SCHEMBL18058129 0.90 DUSP3 (0.32) MEN1KMT2ADUSP3ALDH1A1TSHR
SCHEMBL18058127 0.90 TNF (0.38) MEN1KMT2ADUSP3ALDH1A1TSHR
SCHEMBL18058128 0.87 CCR1 (0.33) DUSP3MAPTSMN1; SMN2L3MBTL1KDM4E
SCHEMBL21588671 0.87 ALDH1A1 (0.42) MEN1KMT2AMAPTL3MBTL1KDM4E
SCHEMBL17989640 0.87 DUSP3 (0.31) DUSP3MAPTSMN1; SMN2L3MBTL1KDM4E
SCHEMBL2603527 0.86 DUSP3 (0.36) DUSP3MAPTSMN1; SMN2L3MBTL1KDM4E
SCHEMBL18058123 0.86 CYP3A4 (0.32) MEN1KMT2ADUSP3MAPTKDM4E
SCHEMBL17989653 0.86 DUSP3 (0.32) MEN1KMT2ADUSP3
SCHEMBL26451336 0.86 DUSP3 (0.34) DUSP3TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL20437701 0.85 DUSP3 (0.33) DUSP3MAPTSMN1; SMN2L3MBTL1KDM4E

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-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 — — US disclosed
US-20160225992-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-08-04 — — US disclosed
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