SCHEMBL788677

SCHEMBL788677

CC(C)(C)c1ccc(-c2cccc3c2sc2c(-c4ccc5[nH]c6ccc(-c7cccc8c7sc7c(-c9ccc(C(C)(C)C)cc9)cccc78)cc6c5c4)cccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.50
ALOX5 P09917 1/20 0.41
TNKS O95271 2/20 0.39
TNKS2 Q9H2K2 2/20 0.39
TRPV1 Q8NER1 3/20 0.36
S1PR4 O95977 1/20 0.36
S1PR5 Q9H228 1/20 0.36
PARP1 P09874 1/20 0.36
BRD4 O60885 1/20 0.36
SCD O00767 1/20 0.35
HDAC6 Q9UBN7 1/20 0.34
GABRA1 P14867 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
GABRA2 P47869 2/20 0.33
GABRA6 Q16445 2/20 0.33
GPR84 Q9NQS5 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
SCHEMBL10227366 0.96 KIF11 (0.57) KIF11ALOX5TNKSTNKS2TRPV1
SCHEMBL15457706 0.89 ALOX5 (0.51) KIF11ALOX5TNKSTNKS2TRPV1
SCHEMBL789849 0.87 KIF11 (0.56) KIF11ALOX5TNKSTNKS2BRD4
SCHEMBL10225908 0.86 ALOX5 (0.44) KIF11ALOX5TNKSTNKS2GABRA1
SCHEMBL788191 0.85 ALOX5 (0.43) KIF11ALOX5TNKSTNKS2PARP1
SCHEMBL10225913 0.84 ALOX5 (0.49) ALOX5TNKSTNKS2
SCHEMBL788850 0.83 KIF11 (0.47) KIF11ALOX5GABRA1GABRG2GABRB3
SCHEMBL788612 0.83 ALOX5 (0.48) ALOX5TNKSTNKS2GABRA1GABRG2
SCHEMBL457228 0.82 ALOX5 (0.47) KIF11ALOX5GABRA1GABRG2GABRB3
SCHEMBL10225909 0.82 ALOX5 (0.43) KIF11ALOX5TNKSTNKS2

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 1162/4885TNKS 4076/4885

“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.