Sugi Predict

Sugi Predict / Compounds / SCHEMBL781408

SCHEMBL781408

SCHEMBL781408

c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cccc(-n5c6ccccc6c6ccc(-c7ccc8c(c7)oc7c(-c9ccccc9)cccc78)cc65)c4)ccc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.38
▸ PRKDC P78527 6/20 0.38
▸ KDM4E B2RXH2 3/20 0.35
▸ ATM Q13315 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ GGPS1 O95749 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ PIK3CD O00329 2/20 0.32
▸ PIK3CA P42336 2/20 0.32
▸ PIK3CB P42338 2/20 0.32
▸ PIK3CG P48736 2/20 0.32
▸ BRD4 O60885 2/20 0.32
▸ BRD2 P25440 2/20 0.32
▸ BRD3 Q15059 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ PDE2A O00408 1/20 0.32
▸ PIK3C2A O00443 1/20 0.32
▸ PIK3R2 O00459 1/20 0.32
▸ PIK3C2B O00750 1/20 0.32
▸ PDE5A O76074 1/20 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
SCHEMBL781201 0.94 ALOX5 (0.46) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL15745739 0.93 KDM4E (0.37) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL781002 0.92 ALOX5 (0.47) ALOX5PRKDCKDM4EATMGGPS1
SCHEMBL781321 0.90 ALOX5 (0.36) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL459097 0.90 ALOX5 (0.46) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL781035 0.89 ALOX5 (0.47) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL23428428 0.89 ALOX5 (0.38) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL23428453 0.89 ALOX5 (0.38) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL780949 0.88 KDM4E (0.37) ALOX5PRKDCKDM4EATML3MBTL1
SCHEMBL23427037 0.88 L3MBTL1 (0.40) ALOX5PRKDCKDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 (1 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-20120071668-A1 Carbazole Derivative, Light-Emitting Element Material and Organic Semiconductor Material SLC39A3, SULT1A1, NUTF2 ALOX5 1162/4885PRKDC 3567/4885KDM4E 3917/4885

“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.