SCHEMBL18804472

SCHEMBL18804472

[N-]=[N+]=NCc1ccc(N(c2ccccc2)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 1/20 0.38
▸ HDAC1 Q13547 2/20 0.37
▸ HDAC2 Q92769 2/20 0.37
▸ TAAR1 Q96RJ0 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HDAC3 O15379 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ ABCC4 O15439 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
SCHEMBL18804475 0.98 GRIN2B (0.39) GRIN2BHDAC1HDAC2TAAR1KDM4E
SCHEMBL18804469 0.93 ALDH1A1 (0.41) GRIN2BHDAC1HDAC2KDM4EALDH1A1
SCHEMBL15233019 0.80 HDAC1 (0.41) HDAC1HDAC2HDAC3HDAC8HDAC6
SCHEMBL18804471 0.80 HDAC3 (0.41) HDAC1HDAC2TAAR1ALDH1A1CYP1A2
Benzene SCHEMBL27800821 0.76 TRPA1 (0.43) GRIN2BHDAC1HDAC2ALDH1A1CYP3A4
SCHEMBL13437571 0.76 TRPA1 (0.43) GRIN2BHDAC1HDAC2ALDH1A1CYP3A4
SCHEMBL17469523 0.75 HDAC3 (0.43) HDAC1HDAC2TAAR1CYP2C19HDAC3
SCHEMBL10204137 0.75 TAAR1 (0.47) TAAR1KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL19861099 0.75 TAAR1 (0.47) TAAR1KDM4EALDH1A1CYP1A2CYP3A4
SCHEMBL14727198 0.75 KCNH2 (0.48) TAAR1KDM4EALDH1A1CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11342503-B2 Organic light emitting device and method of manufacturing the same SAMSUNG DISPLAY CO., LTD. (KR) 2022-05-24 — — US disclosed
US-20200136049-A1 ORGANIC LIGHT EMITTING DEVICE AND METHOD OF MANUFACTURING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2020-04-30 — — US disclosed
US-10553796-B2 Organic light emitting device and method of manufacturing the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-04 — — US disclosed
US-20170125682-A1 ORGANIC LIGHT EMITTING DEVICE AND METHOD OF MANUFACTURING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-04 — — US disclosed
US-20170125682-A1 ORGANIC LIGHT EMITTING DEVICE AND METHOD OF MANUFACTURING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-05-04 — — US disclosed
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