SCHEMBL25768909

SCHEMBL25768909

c1ccc(N(c2ccc(-c3cccc4oc5ccccc5c34)cc2)c2cccc3c2oc2c4ccccc4ccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP1A1 P04798 8/20 0.35
▸ CYP1B1 Q16678 8/20 0.35
▸ CYP1A2 P05177 7/20 0.35
▸ ABCG2 Q9UNQ0 5/20 0.33
▸ ABCC1 P33527 4/20 0.33
▸ ABCB1 P08183 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ PDE5A O76074 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CYP19A1 P11511 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CYP2B6 P20813 1/20 0.33

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
SCHEMBL25768944 0.98 TDP1 (0.37) TDP1L3MBTL1CYP1A1CYP1B1CYP1A2
SCHEMBL25769276 0.97 TDP1 (0.35) TDP1L3MBTL1CYP1A1CYP1B1CYP1A2
SCHEMBL25768949 0.97 TDP1 (0.35) TDP1L3MBTL1CYP1A1CYP1B1CYP1A2
SCHEMBL24888843 0.97 TDP1 (0.35) TDP1L3MBTL1CYP1A1CYP1B1CYP1A2
SCHEMBL25768925 0.96 TDP1 (0.36) TDP1L3MBTL1CYP1A1CYP1B1CYP1A2
SCHEMBL25768915 0.94 CYP1A1 (0.38) TDP1L3MBTL1CYP1A1CYP1B1CYP1A2
SCHEMBL25768934 0.94 CYP1A1 (0.36) TDP1L3MBTL1CYP1A1CYP1B1CYP1A2
SCHEMBL25768918 0.94 CYP1A1 (0.34) TDP1L3MBTL1CYP1A1CYP1B1CYP1A2
SCHEMBL24194564 0.93 ALOX5 (0.38) TDP1L3MBTL1CYP1A1CYP1B1CYP1A2
SCHEMBL24194560 0.93 ALOX5 (0.38) TDP1L3MBTL1CYP1A1CYP1B1CYP1A2

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-20230193123-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 — — US disclosed
US-20230193123-A1 LIGHT EMITTING ELEMENT AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-22 — — US disclosed
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