SCHEMBL16922892

SCHEMBL16922892

CCC1(CC)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3cccc(-c4ccccc4)c3)cc21

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 16/20 0.39
MEN1 O00255 1/20 0.33
APAF1 O14727 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
XBP1 P17861 1/20 0.33
PTBP1 P26599 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
GALK1 P51570 1/20 0.33
BLM P54132 1/20 0.33
SMAD3 P84022 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PGR P06401 2/20 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
SCHEMBL13878189 1.00 PDK2 (0.39) PDK2MEN1APAF1NPC1LMNA
SCHEMBL15870808 0.96 PDK2 (0.40) PDK2MEN1APAF1NPC1LMNA
SCHEMBL13878173 0.95 PDK2 (0.38) PDK2MAPTL3MBTL1PGR
SCHEMBL17678563 0.92 PDK2 (0.39) PDK2PGR
SCHEMBL24119109 0.92 PDK2 (0.34) PDK2
SCHEMBL17153686 0.90 PDK2 (0.40) PDK2MEN1APAF1NPC1LMNA
SCHEMBL5841679 0.90 PDK2 (0.43) PDK2MEN1MAPTKMT2AATM
SCHEMBL13914895 0.90 PDK2 (0.36) PDK2MEN1APAF1NPC1LMNA
SCHEMBL13878163 0.90 PDK2 (0.36) PDK2PGR
SCHEMBL13725520 0.90 RXRA (0.35) PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230058635-A1 ELECTRONIC DEVICE MERCK PATENT GMBH (DE) 2023-02-23 US disclosed
US-11258018-B2 Compounds and organic electronic devices MERCK PATENT GMBH (DE) 2022-02-22 US disclosed
WO-2020108899-A1 ELECTRONIC DEVICE MERCK PATENT GMBH (DE) 2020-06-04 WO disclosed
US-20190348605-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-11-14 US disclosed
US-20170317285-A1 Compounds and Organic Electronic Devices MERCK PATENT GMBH (DE) 2017-11-02 US disclosed
US-20170317285-A1 Compounds and Organic Electronic Devices MERCK PATENT GMBH (DE) 2017-11-02 US disclosed
US-9768391-B2 Derivatives of 2-diarylaminofluorene and organic electronic compounds containing them MERCK PATENT GMBH (DE) 2017-09-19 US disclosed
US-9768391-B2 Derivatives of 2-diarylaminofluorene and organic electronic compounds containing them MERCK PATENT GMBH (DE) 2017-09-19 US disclosed
EP-2875699-B1 DERIVATES OF 2-DIARYLAMINOFLUOREN AND ORGANIC ELECTRONIC DEVICES COMPRISING THE SAME MERCK PATENT GMBH (DE) 2017-02-15 EP disclosed
US-20150207075-A1 DERIVATIVES OF 2-DIARYLAMINOFLUORENE AND ORGANIC ELECTRONIC COMPOUNDS CONTAINING THEM MERCK PATENT GMBH (DE) 2015-07-23 US disclosed
US-20150207075-A1 DERIVATIVES OF 2-DIARYLAMINOFLUORENE AND ORGANIC ELECTRONIC COMPOUNDS CONTAINING THEM MERCK PATENT GMBH (DE) 2015-07-23 US 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 (4 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-20150207075-A1 DERIVATIVES OF 2-DIARYLAMINOFLUORENE AND ORGANIC ELECTRONIC COMPOUNDS CONTAINING THEM DDT, AFF2, CYP2F1 PDK2 718/4885MEN1 514/4885APAF1 2588/4885
US-20190348605-A1 COMPOUNDS AND ORGANIC ELECTRONIC DEVICES ETV6, CYP2C19, AFF2 PDK2 1406/4885MEN1 292/4885APAF1 3911/4885
US-20170317285-A1 Compounds and Organic Electronic Devices ETV6, CYP2C19, AFF2 PDK2 1406/4885MEN1 292/4885APAF1 3911/4885
US-11258018-B2 Compounds and organic electronic devices ETV6, CYP2C19, AFF2 PDK2 1406/4885MEN1 292/4885APAF1 3911/4885

“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.