SCHEMBL10227366

SCHEMBL10227366

CC(C)(C)c1ccc(-c2cccc3c2sc2c(-c4ccc5[nH]c6ccccc6c5c4)cccc23)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 8/20 0.57
ALOX5 P09917 1/20 0.41
TNKS O95271 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
AHR P35869 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
HDAC6 Q9UBN7 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
PARP1 P09874 1/20 0.37
BRD4 O60885 1/20 0.36
SCD O00767 1/20 0.36
CNR1 P21554 1/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35

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
SCHEMBL788677 0.96 KIF11 (0.50) KIF11ALOX5TNKSTNKS2HDAC6
SCHEMBL15457706 0.88 ALOX5 (0.51) KIF11ALOX5TNKSTNKS2MEN1
SCHEMBL788850 0.88 KIF11 (0.47) KIF11ALOX5AHRALDH1A1HSD17B10
SCHEMBL457228 0.87 ALOX5 (0.47) KIF11ALOX5AHRALDH1A1HSD17B10
SCHEMBL789849 0.86 KIF11 (0.56) KIF11ALOX5TNKSTNKS2MEN1
SCHEMBL10227362 0.86 KIF11 (0.46) KIF11ALOX5TNKSTNKS2AHR
SCHEMBL788806 0.85 ALOX5 (0.46) KIF11ALOX5AHRALDH1A1HSD17B10
SCHEMBL10225913 0.84 ALOX5 (0.49) ALOX5TNKSTNKS2AHRALDH1A1
SCHEMBL10225908 0.83 ALOX5 (0.44) KIF11ALOX5TNKSTNKS2AHR
SCHEMBL788889 0.83 ALOX5 (0.44) KIF11ALOX5TNKS2AHRALDH1A1

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.