SCHEMBL983924

SCHEMBL983924

CC(C)(C)c1ccc2c(Cc3cccc4ccccc34)c3cc(C(C)(C)C)ccc3c(Cc3cccc4ccccc34)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.49
NR1I2 O75469 1/20 0.49
LMNA P02545 1/20 0.49
ADRA2A P08913 1/20 0.49
ACHE P22303 1/20 0.49
SLC6A2 P23975 1/20 0.49
HTR2A P28223 1/20 0.49
SLC6A4 P31645 1/20 0.49
KCNH2 Q12809 1/20 0.49
SIGMAR1 Q99720 1/20 0.49
MEN1 O00255 1/20 0.47
HPGD P15428 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 1/20 0.43
CYP19A1 P11511 1/20 0.42
CETP P11597 1/20 0.42
KIF11 P52732 2/20 0.41
CYP2C19 P33261 4/20 0.40
CYP1A2 P05177 2/20 0.40
NQO1 P15559 2/20 0.40

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
SCHEMBL1133510 0.90 CYP2D6 (0.47) CYP2D6NR1I2LMNAADRA2AACHE
SCHEMBL4642360 0.75 HTR2A (0.52) CYP2D6LMNAADRA2AHTR2AALDH1A1
SCHEMBL29854083 0.75 HTR2A (0.52) CYP2D6LMNAADRA2AHTR2AALDH1A1
SCHEMBL1205626 0.73 HPRT1 (0.56) MEN1HPGDKMT2AALDH1A1KIF11
SCHEMBL24809970 0.73 ALDH1A1 (0.56) CYP2D6NR1I2LMNAADRA2AACHE
SCHEMBL10409091 0.71 ALDH1A1 (0.54) CYP2D6NR1I2LMNAADRA2AACHE
SCHEMBL981458 0.71 GAA (0.40) CYP2D6ADRA2AKIF11CYP2C19CYP1A2
SCHEMBL4562721 0.71 CYP1A2 (0.41) CYP2D6NR1I2LMNAADRA2AACHE
SCHEMBL28384010 0.70 KIF11 (0.59) CYP2D6LMNAMEN1HPGDKMT2A
SCHEMBL5050124 0.70 KIF11 (0.44) CYP2D6NR1I2LMNAADRA2AACHE

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 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1786885-B1 ELECTROLUMINESCENT MATERIALS AND DEVICES MERCK PATENT GMBH (DE) 2011-05-18 EP claimed
US-20070252108-A1 Electroluminescent Materials and Devices MERCK PATENT GMBH (DE) 2007-11-01 US claimed
EP-2984079-B1 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES POWER OLEDS LTD (GB) 2020-07-01 EP disclosed
US-10439147-B2 Heterocyclic compounds and their use in electro-optical or opto-electronic devices POWER OLEDS LIMITED (GB) 2019-10-08 US disclosed
US-20180323378-A9 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES POWER OLEDS LIMITED (GB) 2018-11-08 US disclosed
EP-2232611-B1 BARRIER COATED SUBSTRATE AND ELECTRO-OPTICAL DEVICE MERCK PATENT GMBH (DE) 2017-11-01 EP disclosed
US-9437828-B2 Electroluminescent device using azomethine-lithium-complex as electron injection layer MERCK PATENT GMBH (DE) 2016-09-06 US disclosed
EP-2984079-A2 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES Power Oleds Limited (GB) 2016-02-17 EP disclosed
US-20160035983-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES POWER OLEDS LTD (GB) 2016-02-04 US disclosed
US-9221770-B2 Compounds having electron transport properties, their preparation and use MERCK PATENT GMBH (DE) 2015-12-29 US disclosed
EP-2318474-B1 COMPOUND HAVING ELECTROLUMINESCENT OR ELECTRON TRANSPORT PROPERTIES AND ITS PREPARATION AND USE MERCK PATENT GMBH (DE) 2015-05-27 EP disclosed
EP-1946392-A2 ELECTROLUMINESCENT DEVICES OLED-T LIMITED (GB) 2008-07-23 EP disclosed
WO-2008081178-A1 ELECTROLUMINESCENT DEVICE USING AZOMETHINE-LITHIUM-COMPLEX AS ELECTRON INJECTION LAYER MERCK PATENT GMBH (DE) 2008-07-10 WO disclosed
WO-2008078114-A1 ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2008-07-03 WO disclosed
WO-2008078115-A1 PHENANTHROLINE COMPOUNDS AND ELECTROLUMINESCENT DEVICES USING THE SAME MERCK PATENT GMBH (DE) 2008-07-03 WO disclosed
US-20070252108-A1 Electroluminescent Materials and Devices MERCK PATENT GMBH (DE) 2007-11-01 US disclosed
EP-1786885-A1 ELECTROLUMINESCENT MATERIALS AND DEVICES OLED-T LIMITED (GB) 2007-05-23 EP disclosed
WO-2007052083-A2 ELECTROLUMINESCENT DEVICES OLED-T LIMITED (GB) 2007-05-10 WO disclosed
WO-2006090098-A1 ELECTROLUMINESCENT MATERIALS AND DEVICES OLED-T LIMITED (GB) 2006-08-31 WO disclosed
WO-2006016176-A1 ELECTROLUMINESCENT MATERIALS AND DEVICES OLED-T LIMITED (GB) 2006-02-16 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 (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-20180323378-A9 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES NAT1, SLCO2A1, SLCO2B1 CYP2D6 971/4885NR1I2 465/4885LMNA 1637/4885
US-20070252108-A1 Electroluminescent Materials and Devices AAAS, ANXA1, ANXA2 CYP2D6 2354/4885NR1I2 3639/4885LMNA 578/4885
US-10439147-B2 Heterocyclic compounds and their use in electro-optical or opto-electronic devices NAT1, SLCO2A1, SLCO2B1 CYP2D6 971/4885NR1I2 465/4885LMNA 1637/4885
US-20160035983-A1 HETEROCYCLIC COMPOUNDS AND THEIR USE IN ELECTRO-OPTICAL OR OPTO-ELECTRONIC DEVICES NAT1, SLCO2A1, SLCO2B1 CYP2D6 971/4885NR1I2 465/4885LMNA 1637/4885

“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.