SCHEMBL780818

SCHEMBL780818

c1ccc(-c2c3ccccc3c(-c3ccc(-n4c5ccc(-c6cccc7c6sc6c(-c8cccc9ccccc89)cccc67)cc5c5cc(-c6cccc7c6sc6c(-c8cccc9ccccc89)cccc67)ccc54)cc3)c3ccccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.36
MCL1 Q07820 2/20 0.33
ACMSD Q8TDX5 1/20 0.33
LIMK1 P53667 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ATM Q13315 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
NTSR1 P30989 2/20 0.32
KMT2A Q03164 1/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
S1PR4 O95977 1/20 0.31
S1PR5 Q9H228 1/20 0.31
MAPT P10636 2/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
CA12 O43570 4/20 0.30
CA1 P00915 4/20 0.30
CA2 P00918 4/20 0.30
CA9 Q16790 4/20 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
SCHEMBL780858 0.98 KDM4E (0.36) ALOX5MCL1ACMSDLIMK1KDM4E
SCHEMBL780929 0.93 ALOX5 (0.36) ALOX5MCL1ACMSDLIMK1KDM4E
SCHEMBL780673 0.92 ALOX5 (0.39) ALOX5LIMK1KDM4EATML3MBTL1
SCHEMBL780944 0.91 ALOX5 (0.34) ALOX5LIMK1KDM4EATML3MBTL1
SCHEMBL780945 0.91 CYP1A1 (0.35) ALOX5MCL1ACMSDLIMK1KDM4E
SCHEMBL780938 0.91 KDM4E (0.36) ALOX5MCL1ACMSDLIMK1KDM4E
SCHEMBL780924 0.91 S1PR5 (0.37) ALOX5LIMK1KDM4EATML3MBTL1
SCHEMBL780825 0.91 ALOX5 (0.37) ALOX5LIMK1KDM4EATML3MBTL1
SCHEMBL781280 0.91 ALOX5 (0.39) ALOX5LIMK1KDM4EATML3MBTL1
SCHEMBL5947011 0.90 ALOX5 (0.36) ALOX5LIMK1KDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160380211-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-12-29 US disclosed
US-9450188-B2 Carbazole derivative, light-emitting element material and organic semiconductor material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-09-20 US disclosed
US-9450188-B2 Carbazole derivative, light-emitting element material and organic semiconductor material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-09-20 US disclosed
US-20140145175-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-05-29 US disclosed
US-20140145175-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-05-29 US disclosed
US-8642782-B2 Carbazole derivative, light-emitting element material and organic semiconductor material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2014-02-04 US disclosed
US-20120071668-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-03-22 US disclosed
US-20120071668-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-03-22 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 (2 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-20160380211-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SLC39A3, SULT1A1, NUTF2 ALOX5 1162/4885MCL1 4586/4885ACMSD 1100/4885
US-20120071668-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SLC39A3, SULT1A1, NUTF2 ALOX5 1162/4885MCL1 4586/4885ACMSD 1100/4885

“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.