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SCHEMBL12699604

SCHEMBL12699604

c1ccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2cc(-n4c5ccccc5c5cc(-c6ccccc6)ccc54)ccc2-3)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 9/20 0.38
▸ TSPO P30536 2/20 0.37
▸ HDAC4 P56524 1/20 0.34
▸ EDNRB P24530 1/20 0.33
▸ EDNRA P25101 1/20 0.33
▸ DNM1 Q05193 1/20 0.32
▸ 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

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
SCHEMBL23746183 1.00 ATM (0.39) ATML3MBTL1KDM4EPDK2TSPO
SCHEMBL20232369 0.99 ATM (0.38) ATML3MBTL1KDM4EPDK2TSPO
SCHEMBL23370380 0.99 L3MBTL1 (0.41) ATML3MBTL1KDM4EPDK2TSPO
SCHEMBL21104270 0.97 L3MBTL1 (0.44) ATML3MBTL1KDM4EPDK2TSPO
SCHEMBL13775006 0.97 KDM4E (0.41) ATML3MBTL1KDM4EPDK2TSPO
SCHEMBL13775000 0.96 L3MBTL1 (0.43) ATML3MBTL1KDM4EPDK2TSPO
SCHEMBL23468768 0.96 ATM (0.40) ATML3MBTL1KDM4EPDK2TSPO
SCHEMBL25496018 0.96 PDK2 (0.40) ATML3MBTL1KDM4EPDK2TSPO
SCHEMBL21138934 0.96 PDK2 (0.40) ATML3MBTL1KDM4EPDK2TSPO
SCHEMBL21138928 0.96 KDM4E (0.39) ATML3MBTL1KDM4EPDK2TSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2627730-B1 FORMULATIONS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2020-05-06 — — EP disclosed
EP-2627732-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2017-12-20 — — EP disclosed
US-9653687-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2017-05-16 — — US disclosed
US-9653687-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2017-05-16 — — US disclosed
US-8786181-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-07-22 — — US disclosed
US-8786181-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-07-22 — — US disclosed
US-20130228767-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK 2013-09-05 — — US disclosed
US-20130228767-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK 2013-09-05 — — US disclosed
US-20130207095-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Fraunhofer-Gesellschaft Forderung E.V. (DE) 2013-08-15 — — US disclosed
US-20130207095-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Fraunhofer-Gesellschaft Forderung E.V. (DE) 2013-08-15 — — US disclosed
US-20130200357-A1 FORMULATIONS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2013-08-08 — — US disclosed
US-20130200357-A1 FORMULATIONS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2013-08-08 — — US disclosed
WO-2012048900-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES FRAUNHOFER-GESELLSCHAFT ZUR FÖRDERUNG DER ANGEWANDTEN FORSCHUNG E.V. . (DE) 2012-04-19 — — WO disclosed