SCHEMBL25769005

SCHEMBL25769005

c1ccc(-c2ccccc2N(c2cccc3c2oc2ccccc23)c2cccc3c2oc2c4ccccc4ccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A1 P04798 10/20 0.39
▸ CYP1A2 P05177 10/20 0.39
▸ CYP1B1 Q16678 10/20 0.39
▸ ABCG2 Q9UNQ0 3/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ HPGD P15428 3/20 0.39
▸ ABCC1 P33527 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ TP53 P04637 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ PRKDC P78527 2/20 0.39
▸ PDE5A O76074 1/20 0.39
▸ ABCB1 P08183 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP19A1 P11511 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL27316820 0.96 ALOX5 (0.40) CYP1A1CYP1A2CYP1B1ABCG2KDM4E
SCHEMBL26385390 0.93 CYP1A1 (0.36) CYP1A1CYP1A2CYP1B1ABCG2KDM4E
SCHEMBL27313809 0.92 ALOX5 (0.43) CYP1A1CYP1A2CYP1B1ABCG2KDM4E
SCHEMBL25769077 0.92 TDP1 (0.37) CYP1A1CYP1A2CYP1B1ABCG2KDM4E
SCHEMBL25768840 0.91 ALOX5 (0.42) CYP1A1CYP1A2CYP1B1ABCG2KDM4E
SCHEMBL25607791 0.90 CYP1A1 (0.38) CYP1A1CYP1A2CYP1B1ABCG2KDM4E
SCHEMBL25603648 0.89 L3MBTL1 (0.41) CYP1A1CYP1A2CYP1B1ABCG2KDM4E
SCHEMBL25769022 0.89 ALOX5 (0.39) CYP1A1CYP1A2CYP1B1ABCG2KDM4E
SCHEMBL15852109 0.89 CYP1A1 (0.36) CYP1A1CYP1A2CYP1B1ABCG2KDM4E
SCHEMBL24888549 0.89 CYP1A1 (0.38) CYP1A1CYP1A2CYP1B1ABCG2KDM4E

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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