SCHEMBL14886397

SCHEMBL14886397

CC1(C)c2ccccc2-c2cc3c4ccccc4n(-c4ccc5c6ccc(-n7c8ccc(-c9ccccc9)cc8c8cc(-c9ccccc9)ccc87)cc6c6ccccc6c5c4)c3cc21

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HDAC4 P56524 1/20 0.32
▸ RXRA P19793 1/20 0.32
▸ RXRB P28702 1/20 0.32
▸ RAC2 P15153 1/20 0.31
▸ RAC3 P60763 1/20 0.31
▸ CDC42 P60953 1/20 0.31
▸ RAC1 P63000 1/20 0.31
▸ PDK2 Q15119 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
SCHEMBL14886351 1.00 TSPO (0.34) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL16076433 0.99 KDM4E (0.33) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL14886240 0.98 KDM4E (0.37) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL14886343 0.98 PDK2 (0.32) TSPOPDK2
SCHEMBL14886329 0.98 PDK2 (0.32) TSPOPDK2
SCHEMBL14886238 0.97 KDM4E (0.33) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL14886337 0.97 KDM4E (0.33) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL14886302 0.97 KDM4E (0.33) TSPOKDM4EATML3MBTL1HDAC4
SCHEMBL16076389 0.97 KDM4E (0.32) KDM4EATML3MBTL1
SCHEMBL14886395 0.96 KDM4E (0.38) TSPOKDM4EATML3MBTL1HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9978957-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2018-05-22 — — US disclosed
US-9978957-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2018-05-22 — — US disclosed
EP-2768808-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-11-15 — — EP disclosed
US-20170018722-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-01-19 — — US disclosed
US-20170018722-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-01-19 — — US disclosed
US-9515266-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2016-12-06 — — US disclosed
US-9515266-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2016-12-06 — — US disclosed
US-20140275530-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2014-09-18 — — US disclosed
US-20140275530-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2014-09-18 — — US disclosed
WO-2013056776-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2013-04-25 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170018722-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES EFNA1, TTI1, TERT TSPO 406/4885KDM4E 2652/4885ATM 2760/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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