SCHEMBL788744

SCHEMBL788744

Cc1ccc2[nH]c3ccc(-c4cccc5c4oc4ccccc45)cc3c2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.54
NPC1 O15118 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.43
GGPS1 O95749 1/20 0.41
PRKDC P78527 1/20 0.41
KIF11 P52732 2/20 0.41
PTGES2 Q9H7Z7 1/20 0.39
PIM1 P11309 1/20 0.38
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
PIM3 Q86V86 1/20 0.38
PIM2 Q9P1W9 1/20 0.38
MAOB P27338 2/20 0.38
TNKS O95271 1/20 0.38
PARP1 P09874 1/20 0.38
TNKS2 Q9H2K2 1/20 0.38
PARP2 Q9UGN5 1/20 0.38
ACHE P22303 1/20 0.38

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
SCHEMBL788513 0.94 ALOX5 (0.53) ALOX5NPC1MEN1KMT2APOLB
SCHEMBL768872 0.92 ALOX5 (0.62) ALOX5GGPS1PRKDCKIF11PTGES2
SCHEMBL18381878 0.91 ALOX5 (0.61) ALOX5GGPS1PRKDCKIF11PTGES2
SCHEMBL30487044 0.89 ALOX5 (0.59) ALOX5MEN1KMT2AGGPS1PRKDC
SCHEMBL30395989 0.89 ALOX5 (0.59) ALOX5MEN1KMT2AGGPS1PRKDC
SCHEMBL457912 0.89 ALOX5 (0.59) ALOX5MEN1KMT2AGGPS1PRKDC
SCHEMBL18381837 0.88 ALOX5 (0.58) ALOX5MEN1KMT2AGGPS1PRKDC
SCHEMBL788623 0.88 ALOX5 (0.50) ALOX5GGPS1PRKDCPTGES2MAOB
SCHEMBL26022312 0.88 KIF11 (0.47) ALOX5NPC1MEN1KMT2APOLB
SCHEMBL12925462 0.88 ALOX5 (0.43) ALOX5NPC1MEN1KMT2APOLB

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 1162/4885NPC1 892/4885MEN1 3326/4885

“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.