SCHEMBL788608

SCHEMBL788608

c1ccc(-c2cc(-c3ccccc3)c3sc4c(-c5ccc6[nH]c7ccccc7c6c5)cc(-c5ccccc5)cc4c3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.43
HPGD P15428 3/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 3/20 0.40
ALDH1A1 P00352 3/20 0.40
GPR3 P46089 1/20 0.40
KIF11 P52732 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP13 P45452 1/20 0.39
CDK4 P11802 1/20 0.38
CCND1 P24385 1/20 0.38
GABRP O00591 1/20 0.37

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
SCHEMBL788260 0.96 CDK4 (0.40) AHRHPGDMAPK1HTTSMN1; SMN2
SCHEMBL788279 0.93 AHR (0.42) AHRHPGDMAPK1HTTSMN1; SMN2
SCHEMBL10227353 0.91 LIMK1 (0.40) AHRHPGDMAPK1HTTSMN1; SMN2
SCHEMBL10227377 0.91 LIMK1 (0.40) AHRHPGDMAPK1HTTSMN1; SMN2
SCHEMBL788806 0.89 ALOX5 (0.46) AHRHPGDMAPK1HTTSMN1; SMN2
SCHEMBL788263 0.88 TNKS2 (0.41) AHRHPGDMAPK1HTTSMN1; SMN2
SCHEMBL10227355 0.88 LIMK1 (0.39) AHRHPGDMAPK1HTTSMN1; SMN2
SCHEMBL457228 0.87 ALOX5 (0.47) AHRHPGDMAPK1HTTSMN1; SMN2
SCHEMBL10227354 0.87 TNKS (0.39) AHRHPGDMAPK1HTTSMN1; SMN2
SCHEMBL788550 0.86 LIMK1 (0.43) MEN1KMT2AMAPTCDK4CCND1

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 AHR 71/4885HPGD 1834/4885MAPK1 3361/4885

“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.