SCHEMBL22180550

SCHEMBL22180550

c1cc(-c2cccc3c2[nH]c2ccccc23)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.42
▸ ATM Q13315 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ KIF11 P52732 4/20 0.41
▸ PARP14 Q460N5 6/20 0.39
▸ TDO2 P48775 4/20 0.39
▸ IDO1 P14902 1/20 0.39
▸ HTR2B P41595 1/20 0.38
▸ HTR5A P47898 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ BCHE P06276 1/20 0.38
▸ CDK4 P11802 3/20 0.38
▸ CCND1 P24385 3/20 0.38
▸ CCNB2 O95067 1/20 0.38
▸ CCNE2 O96020 1/20 0.38
▸ CDK1 P06493 1/20 0.38
▸ CCNB1 P14635 1/20 0.38
▸ CCNE1 P24864 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ CCNB3 Q8WWL7 1/20 0.38

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
SCHEMBL30789336 1.00 KDM4E (0.42) KDM4EATML3MBTL1KIF11PARP14
SCHEMBL25711606 0.97 KDM4E (0.40) KDM4EATML3MBTL1KIF11PARP14
SCHEMBL16625479 0.95 KDM4E (0.38) KDM4EATML3MBTL1KIF11PARP14
SCHEMBL21214749 0.94 KDM4E (0.37) KDM4EATML3MBTL1KIF11PARP14
SCHEMBL29006767 0.93 KDM4E (0.39) KDM4EATML3MBTL1KIF11PARP14
SCHEMBL29774746 0.90 KIF11 (0.41) KDM4EATML3MBTL1KIF11PARP14
SCHEMBL18896081 0.89 BCHE (0.39) KDM4EATML3MBTL1KIF11PARP14
SCHEMBL21375324 0.88 KDM4E (0.46) KDM4EATML3MBTL1KIF11PARP14
SCHEMBL25207668 0.88 PARP14 (0.46) KDM4EPARP14TDO2CCNB2CDK1
SCHEMBL30273408 0.88 PARP14 (0.46) KDM4EPARP14TDO2CCNB2CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3675194-A1 ORGANIC LIGHT-EMITTING DEVICE AND APPARATUS INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2020-07-01 — — EP disclosed
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