SCHEMBL788802

SCHEMBL788802

c1ccc2cc(-c3cccc4c3sc3c(-c5ccc6[nH]c7ccccc7c6c5)cccc34)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.44
HTR5A P47898 1/20 0.44
ALOX5 P09917 1/20 0.44
AHR P35869 1/20 0.41
ALDH1A1 P00352 2/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE9A O76083 1/20 0.40
S1PR5 Q9H228 6/20 0.39
S1PR4 O95977 5/20 0.39
GSTP1 P09211 1/20 0.38
GPR3 P46089 1/20 0.38
KIF11 P52732 4/20 0.37
PIM1 P11309 1/20 0.37
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36

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
SCHEMBL787921 0.97 ALOX5 (0.46) HTR2BHTR5AALOX5ALDH1A1HSD17B10
SCHEMBL10225920 0.90 ALOX5 (0.54) HTR2BHTR5AALOX5MEN1MAPT
SCHEMBL788890 0.89 ALOX5 (0.44) ALOX5AHRALDH1A1HSD17B10KDM4E
SCHEMBL457228 0.87 ALOX5 (0.47) ALOX5AHRALDH1A1HSD17B10KDM4E
SCHEMBL788806 0.86 ALOX5 (0.46) HTR2BHTR5AALOX5AHRALDH1A1
SCHEMBL10225911 0.86 ALOX5 (0.46) ALOX5AHRALDH1A1HSD17B10KDM4E
SCHEMBL10227359 0.85 ALOX5 (0.45) HTR2BHTR5AALOX5AHRALDH1A1
SCHEMBL26022356 0.85 ALOX5 (0.58) ALOX5AHRALDH1A1HSD17B10KDM4E
SCHEMBL457901 0.85 ALOX5 (0.61) ALOX5AHRALDH1A1HSD17B10KDM4E
SCHEMBL31664386 0.85 ALOX5 (0.61) ALOX5AHRALDH1A1HSD17B10KDM4E

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 HTR2B 711/4885HTR5A 904/4885ALOX5 1162/4885

“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.