SCHEMBL12372912

SCHEMBL12372912

c1ccc(-n2c3ccccc3c3cc(N(c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4ccc5c6cccc7cccc(c8cccc4c85)c76)ccc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ BRCA1 P38398 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ ERBB2 P04626 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ MAOA P21397 1/20 0.31
▸ ACHE P22303 1/20 0.31
▸ AHR P35869 1/20 0.31
▸ JAK2 O60674 1/20 0.30
▸ JAK3 P52333 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
SCHEMBL23954347 0.91 KDM4E (0.34) KDM4EATML3MBTL1ALDH1A1POLB
SCHEMBL25026628 0.90 KDM4E (0.33) KDM4EATML3MBTL1ALDH1A1MEN1
SCHEMBL14848579 0.89 KDM4E (0.43) KDM4EATML3MBTL1ALDH1A1TSHR
SCHEMBL14848517 0.89 KDM4E (0.45) KDM4EATML3MBTL1ALDH1A1TSHR
SCHEMBL14282545 0.89 KDM4E (0.42) KDM4EATML3MBTL1ALDH1A1HSD17B10
SCHEMBL16520682 0.89 KDM4E (0.40) KDM4EATML3MBTL1ALDH1A1TSHR
SCHEMBL26851798 0.87 KDM4E (0.41) KDM4EATML3MBTL1ALDH1A1TSHR
SCHEMBL16520708 0.87 KDM4E (0.36) KDM4EATML3MBTL1ALDH1A1TSHR
SCHEMBL7248759 0.86 L3MBTL1 (0.35) KDM4EATML3MBTL1ALDH1A1TSHR
SCHEMBL14848602 0.86 L3MBTL1 (0.40) KDM4EATML3MBTL1ALDH1A1TSHR

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-20230050869-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 — — US disclosed
EP-3902021-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH Toyo Ink SC Holdings Co., Ltd. (JP) 2021-10-27 — — EP disclosed
US-7998596-B2 Aromatic amine derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2011-08-16 — — US disclosed
US-7998596-B2 Aromatic amine derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2011-08-16 — — US disclosed
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