SCHEMBL788722

SCHEMBL788722

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.51
KIF11 P52732 2/20 0.45
TNKS O95271 1/20 0.41
PARP1 P09874 1/20 0.41
TNKS2 Q9H2K2 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
PARP2 Q9UGN5 1/20 0.41
GGPS1 O95749 1/20 0.39
PRKDC P78527 2/20 0.39
PTGES2 Q9H7Z7 1/20 0.37
KDM4E B2RXH2 1/20 0.35
CYP2C9 P11712 1/20 0.35
NQO1 P15559 1/20 0.35
CRHBP P24387 1/20 0.35
CASP7 P55210 1/20 0.35
CASP6 P55212 1/20 0.35
CRHR2 Q13324 1/20 0.35
HIF1A Q16665 1/20 0.35
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 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
SCHEMBL768872 0.89 ALOX5 (0.62) ALOX5KIF11GGPS1PRKDCPTGES2
SCHEMBL9916157 0.88 ALOX5 (0.56) ALOX5KIF11TNKSPARP1TNKS2
SCHEMBL18381878 0.87 ALOX5 (0.61) ALOX5KIF11GGPS1PRKDCPTGES2
SCHEMBL457912 0.86 ALOX5 (0.59) ALOX5KIF11GGPS1PRKDCPTGES2
SCHEMBL30395989 0.86 ALOX5 (0.59) ALOX5KIF11GGPS1PRKDCPTGES2
SCHEMBL30487044 0.86 ALOX5 (0.59) ALOX5KIF11GGPS1PRKDCPTGES2
SCHEMBL18381837 0.85 ALOX5 (0.58) ALOX5KIF11GGPS1PRKDCPTGES2
SCHEMBL788744 0.84 ALOX5 (0.54) ALOX5KIF11TNKSPARP1TNKS2
SCHEMBL10226934 0.84 KIF11 (0.49) ALOX5KIF11TNKSPARP1TNKS2
SCHEMBL788745 0.84 ALOX5 (0.57) ALOX5HDAC6GGPS1PRKDCPTGES2

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 ALOX5 1162/4885KIF11 1085/4885TNKS 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.