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Sugi Predict / Compounds / SCHEMBL133504

SCHEMBL133504

SCHEMBL133504

CC1(C)c2cc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)ccc2-c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4cccc5ccccc45)cc3)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 11/20 0.40
▸ PDK2 Q15119 2/20 0.34
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ DHFR P00374 1/20 0.32
▸ MEN1 O00255 3/20 0.31
▸ KMT2A Q03164 3/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CRHBP P24387 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ CRHR2 Q13324 1/20 0.31
▸ TLR9 Q9NR96 1/20 0.31

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
SCHEMBL15138682 1.00 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1KDM4EMAPT
SCHEMBL12640117 1.00 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1KDM4EMAPT
SCHEMBL4084514 0.99 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1KDM4EMAPT
SCHEMBL29511997 0.99 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1KDM4EMAPT
SCHEMBL29390340 0.99 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1KDM4EMAPT
SCHEMBL17693517 0.99 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1KDM4EMAPT
SCHEMBL14073327 0.97 SIGMAR1 (0.38) SIGMAR1PDK2L3MBTL1KDM4EMAPT
SCHEMBL15495964 0.97 SIGMAR1 (0.40) SIGMAR1PDK2L3MBTL1KDM4EMAPT
SCHEMBL13854504 0.96 SIGMAR1 (0.37) SIGMAR1PDK2L3MBTL1DHFR
SCHEMBL22936727 0.96 SIGMAR1 (0.37) SIGMAR1PDK2L3MBTL1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230329092-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-10-12 — — US disclosed
US-20230225196-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-07-13 — — US disclosed
US-20230225196-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-07-13 — — US disclosed
EP-3762387-B1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-07-12 — — EP disclosed
WO-2023099430-A1 TRIPHENYLENE-TRIAZINE-DIBENZOFURAN/DIBENZOTHIOPHENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-06-08 — — WO disclosed
EP-4186898-A1 COMPOSITION FOR ORGANIC ELECTRONIC COMPOUNDS Merck Patent GmbH (DE) 2023-05-31 — — EP disclosed
US-20230159434-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-05-25 — — US disclosed
US-20230159434-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-05-25 — — US disclosed
US-20230150987-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-05-18 — — US disclosed
US-20230150987-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-05-18 — — US disclosed
US-20110037063-A1 NOVEL MATERILS FOR ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2011-02-17 — — US disclosed
US-20110037063-A1 NOVEL MATERILS FOR ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2011-02-17 — — US disclosed
WO-2011006568-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-01-20 — — WO disclosed
WO-2010149259-A2 CONDUCTING FORMULATION MERCK PATENT GMBH (DE) 2010-12-29 — — WO disclosed
WO-2010115498-A1 ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2010-10-14 — — WO disclosed
WO-2010108579-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2010-09-30 — — WO disclosed
WO-2010094378-A1 ORGANIC ELECTRONIC DEVICE MERCK PATENT GMBH (DE) 2010-08-26 — — WO disclosed
WO-2010083869-A2 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2010-07-29 — — WO disclosed
WO-2010012330-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2010-02-04 — — WO disclosed
WO-2009127307-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2009-10-22 — — 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 (5 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-20230150987-A1 COMPOSITION FOR ORGANIC ELECTRONIC DEVICES SLCO2B1, SLCO2A1, SLCO1B3 SIGMAR1 2669/4885PDK2 2425/4885L3MBTL1 3258/4885
US-20230329092-A1 MATERIALS FOR ELECTRONIC DEVICES SOD1, GPX1, EFNA1 SIGMAR1 3289/4885PDK2 319/4885L3MBTL1 4497/4885
US-20110037063-A1 NOVEL MATERILS FOR ORGANIC ELECTROLUMINESCENCE DEVICE L1CAM, EML4, SLC40A1 SIGMAR1 2172/4885PDK2 2279/4885L3MBTL1 1818/4885
US-20230159434-A1 MATERIALS FOR ELECTRONIC DEVICES OCIAD2, AOC2, OCIAD1 SIGMAR1 1340/4885PDK2 741/4885L3MBTL1 2527/4885
US-20230225196-A1 MATERIALS FOR ELECTRONIC DEVICES SELE, EPHA6, EPX SIGMAR1 3354/4885PDK2 1021/4885L3MBTL1 2697/4885

“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.