SCHEMBL20168936

SCHEMBL20168936

c1ccc(-c2cc(-c3ccccc3)cc(-c3ccc4c(c3)-c3ccccc3C43c4ccc(-n5c6ccccc6c6ccccc65)cc4-c4cc(-n5c6ccccc6c6ccccc65)ccc43)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ PDK2 Q15119 2/20 0.35
▸ HDAC4 P56524 1/20 0.34
▸ MEN1 O00255 1/20 0.32
▸ APAF1 O14727 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ XBP1 P17861 1/20 0.32
▸ PTBP1 P26599 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ GALK1 P51570 1/20 0.32
▸ BLM P54132 1/20 0.32
▸ SMAD3 P84022 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL15087889 1.00 ATM (0.39) ATML3MBTL1KDM4EPDK2HDAC4
SCHEMBL20411906 0.92 KDM4E (0.39) ATML3MBTL1KDM4EPDK2HDAC4
SCHEMBL17854693 0.91 ATM (0.40) ATML3MBTL1KDM4EPDK2HDAC4
SCHEMBL14595493 0.90 PDK2 (0.41) ATML3MBTL1KDM4EPDK2HDAC4
SCHEMBL18160230 0.89 L3MBTL1 (0.43) ATML3MBTL1KDM4EPDK2HDAC4
SCHEMBL17854688 0.88 KDM4E (0.40) ATML3MBTL1KDM4EPDK2HDAC4
SCHEMBL21138923 0.88 KDM4E (0.39) ATML3MBTL1KDM4EPDK2HDAC4
SCHEMBL15213619 0.88 PDK2 (0.38) ATML3MBTL1KDM4EPDK2MEN1
SCHEMBL27016268 0.88 KDM4E (0.42) ATML3MBTL1KDM4EPDK2MEN1
SCHEMBL22928199 0.88 KDM4E (0.46) ATML3MBTL1KDM4EPDK2HDAC4

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-9978946-B2 Spirobifluorene compound for light emitting devices SUMITOMO CHEMICAL CO., LTD. (JP) 2018-05-22 — — US disclosed
US-9978946-B2 Spirobifluorene compound for light emitting devices SUMITOMO CHEMICAL CO., LTD. (JP) 2018-05-22 — — US disclosed
Send feedback