SCHEMBL2085368

SCHEMBL2085368

Brc1c2ccccc2c(-c2cc(-c3ccccc3)cc(-c3ccccc3)c2)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
MAPK1 P28482 3/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PTPN1 P18031 2/20 0.37
ACHE P22303 2/20 0.36
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
AKR1C4 P17516 1/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
GPR84 Q9NQS5 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33

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
SCHEMBL19862724 0.94 MAPK1 (0.44) CRHBPCRHR2MAPK1ALDH1A1KDM4E
SCHEMBL15480736 0.92 CRHBP (0.41) CRHBPCRHR2MAPK1ALDH1A1KDM4E
SCHEMBL14181764 0.91 PTPN1 (0.41) CRHBPCRHR2MAPK1ALDH1A1KDM4E
SCHEMBL30410472 0.89 MAOA (0.40) CRHBPCRHR2MAPK1ALDH1A1KDM4E
SCHEMBL5955974 0.89 MAOA (0.40) CRHBPCRHR2MAPK1ALDH1A1KDM4E
SCHEMBL22534450 0.89 MAOA (0.40) CRHBPCRHR2MAPK1ALDH1A1KDM4E
Biphenyl SCHEMBL27626716 0.89 MAPK1 (0.48) CRHBPCRHR2MAPK1ALDH1A1KDM4E
SCHEMBL29373135 0.89 ALDH1A1 (0.50) CRHBPCRHR2MAPK1ALDH1A1MAPT
SCHEMBL261400 0.89 ALDH1A1 (0.50) CRHBPCRHR2MAPK1ALDH1A1MAPT
SCHEMBL2082935 0.88 MAPK1 (0.43) CRHBPCRHR2MAPK1ALDH1A1KDM4E

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-20230380267-A1 COMPOUNDS FOR STRUCTURING FUNCTIONAL LAYERS OF ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-11-23 US disclosed
US-20230371363-A1 COMPOUNDS THAT CAN BE USED FOR STRUCTURING FUNCTIONAL LAYERS OF ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-11-16 US disclosed
US-11296282-B2 Organic compound and organic electroluminescence device using the same LUMINESCENCE TECHNOLOGY CORP. (TW) 2022-04-05 US disclosed
US-11038123-B2 Compound and organic electronic device using the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2021-06-15 US disclosed
US-11038124-B2 Organic compound and organic electroluminescence device using the same LUMINESCENCE TECHNOLOGY CORP. (TW) 2021-06-15 US disclosed
US-20200203632-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2020-06-25 US disclosed
WO-2019203491-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2019-10-24 WO disclosed
US-20110049482-A1 Novel aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO., LTD. (JP) 2011-03-03 US disclosed
US-7790892-B2 Aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO., LTD. (JP) 2010-09-07 US disclosed
US-20050214565-A1 Novel aromatic compound and organic electroluminescent element containing the same IDEMITSU KOSAN CO., LTD. (JP) 2005-09-29 US disclosed
EP-1496041-A1 NOVEL AROMATIC COMPOUND AND ORGANIC ELECTROLUMINESCNET ELEMENT CONTAINING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2005-01-12 EP 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 (6 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-11296282-B2 Organic compound and organic electroluminescence device using the same SLCO4C1, EML4, SLCO2A1 CRHBP 4193/4885CRHR2 4824/4885MAPK1 2749/4885
US-11038124-B2 Organic compound and organic electroluminescence device using the same TRPA1, TRPC6, TRPM4 CRHBP 4221/4885CRHR2 4593/4885MAPK1 3670/4885
US-20230371363-A1 COMPOUNDS THAT CAN BE USED FOR STRUCTURING FUNCTIONAL LAYERS OF ORGANIC ELECTROLUMINESCENT DEVICES EPCAM, SELE, CTCF CRHBP 3263/4885CRHR2 4464/4885MAPK1 3351/4885
US-20200203632-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME SLCO4C1, EML4, SLCO2A1 CRHBP 4193/4885CRHR2 4824/4885MAPK1 2749/4885
US-20110049482-A1 Novel aromatic compound and organic electroluminescent element containing the same TYR, EML4, TCF7L2 CRHBP 4652/4885CRHR2 4784/4885MAPK1 916/4885
US-11038123-B2 Compound and organic electronic device using the same CHRM1, CHRM2, C1S CRHBP 4242/4885CRHR2 2148/4885MAPK1 1373/4885

“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.