SCHEMBL789896

SCHEMBL789896

c1ccc(-c2ccc3sc4c(-c5ccc6c(c5)[nH]c5cc(-c7cc(-c8ccccc8)cc8c7sc7ccc(-c9ccccc9)cc78)ccc56)cc(-c5ccccc5)cc4c3c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.41
PIM3 Q86V86 4/20 0.40
TNKS2 Q9H2K2 2/20 0.40
PIM1 P11309 4/20 0.39
PIM2 Q9P1W9 3/20 0.39
CDK4 P11802 2/20 0.39
CCND1 P24385 2/20 0.39
FEN1 P39748 1/20 0.38
TNKS O95271 1/20 0.38
JAK2 O60674 2/20 0.36
ALOX5 P09917 1/20 0.35
IMPDH2 P12268 1/20 0.35
GPR17 Q13304 1/20 0.34
AHR P35869 1/20 0.34
F9 P00740 1/20 0.33
PTGES O14684 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
SCHEMBL788520 0.96 AHR (0.41) LIMK1PIM3TNKS2PIM1PIM2
SCHEMBL786979 0.92 LIMK1 (0.43) LIMK1PIM3TNKS2PIM1PIM2
SCHEMBL788550 0.92 LIMK1 (0.43) LIMK1PIM3TNKS2PIM1PIM2
SCHEMBL10227353 0.91 LIMK1 (0.40) LIMK1PIM3TNKS2PIM1PIM2
SCHEMBL10227377 0.91 LIMK1 (0.40) LIMK1PIM3TNKS2PIM1PIM2
SCHEMBL786981 0.89 LIMK1 (0.41) LIMK1PIM3TNKS2PIM1PIM2
SCHEMBL788263 0.89 TNKS2 (0.41) TNKS2CDK4CCND1FEN1TNKS
SCHEMBL10227355 0.88 LIMK1 (0.39) LIMK1PIM3TNKS2PIM1PIM2
SCHEMBL15179507 0.86 LIMK1 (0.45) LIMK1PIM3TNKS2PIM1PIM2
SCHEMBL26047394 0.86 ALOX5 (0.47) LIMK1PIM3TNKS2PIM1PIM2

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 LIMK1 3472/4885PIM3 2594/4885TNKS2 3776/4885

“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.