SCHEMBL788686

SCHEMBL788686

CC(C)(C)c1ccc2[nH]c3ccc(-c4cccc5c4oc4ccccc45)cc3c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 6/20 0.55
▸ ALOX5 P09917 2/20 0.51
▸ GGPS1 O95749 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ PRKDC P78527 2/20 0.39
▸ PTGES2 Q9H7Z7 1/20 0.39
▸ MDH2 P40926 1/20 0.35
▸ GABRA1 P14867 1/20 0.35
▸ GABRG2 P18507 1/20 0.35
▸ GABRB3 P28472 1/20 0.35
▸ GABRA5 P31644 1/20 0.35
▸ GABRA3 P34903 1/20 0.35
▸ GABRA2 P47869 1/20 0.35
▸ GABRA4 P48169 1/20 0.35
▸ GABRA6 Q16445 1/20 0.35
▸ BRD4 O60885 1/20 0.35
▸ SCD O00767 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.33
▸ HSP90AB1 P08238 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
SCHEMBL15457699 0.94 ALOX5 (0.50) KIF11ALOX5GGPS1ALDH1A1MAPT
SCHEMBL768872 0.89 ALOX5 (0.62) KIF11ALOX5GGPS1PRKDCPTGES2
SCHEMBL18381878 0.87 ALOX5 (0.61) KIF11ALOX5GGPS1PRKDCPTGES2
SCHEMBL10226465 0.86 KIF11 (0.50) KIF11ALOX5ALDH1A1MAPTBRD4
SCHEMBL30487044 0.86 ALOX5 (0.59) KIF11ALOX5GGPS1ALDH1A1MAPT
SCHEMBL30395989 0.86 ALOX5 (0.59) KIF11ALOX5GGPS1ALDH1A1MAPT
SCHEMBL457912 0.86 ALOX5 (0.59) KIF11ALOX5GGPS1ALDH1A1MAPT
SCHEMBL787209 0.85 KIF11 (0.57) KIF11ALOX5ALDH1A1MAPTBRD4
SCHEMBL18381837 0.85 ALOX5 (0.58) KIF11ALOX5GGPS1ALDH1A1MAPT
SCHEMBL788744 0.84 ALOX5 (0.54) KIF11ALOX5GGPS1ALDH1A1MAPT

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-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-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

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 KIF11 1085/4885ALOX5 1162/4885GGPS1 2063/4885

“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.

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