SCHEMBL559711

SCHEMBL559711

c1ccc(Nc2cc(-c3ccc(-c4ccccc4)cc3)c3[nH]c4ccccc4c3c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.47
MMP9 P14780 7/20 0.47
MMP13 P45452 7/20 0.47
MMP8 P22894 5/20 0.47
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTR2B P41595 1/20 0.42
HTR5A P47898 1/20 0.42
TDO2 P48775 1/20 0.42
EGFR P00533 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ELANE P08246 1/20 0.39
PARP14 Q460N5 1/20 0.39
NQO2 P16083 1/20 0.39
MGAM O43451 1/20 0.38
KIF11 P52732 2/20 0.38
MAPK10 P53779 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
SCHEMBL20451012 0.91 HPGD (0.40) MMP2MMP9MMP13MMP8HPGD
SCHEMBL2840698 0.84 PARP14 (0.47) MMP2MMP9MMP13MMP8HTR2B
SCHEMBL7048827 0.82 HPGD (0.50) MMP2MMP9MMP13MMP8HPGD
SCHEMBL17177848 0.82 HPGD (0.50) MMP2MMP9MMP13MMP8HPGD
SCHEMBL28697631 0.80 PARP14 (0.48) PARP14KIF11
SCHEMBL4238212 0.80 HPGD (0.51) MMP2MMP9MMP13MMP8HPGD
SCHEMBL11899821 0.78 MMP2 (0.45) MMP2MMP9MMP13MMP8HPGD
SCHEMBL30475214 0.78 HPGD (0.53) MMP2MMP9MMP13MMP8HPGD
SCHEMBL3333761 0.78 PARP14 (0.46) MMP2MMP9MMP13MMP8HTR2B
SCHEMBL21647224 0.77 GABRP (0.46) MMP2MMP9MMP13MMP8HPGD

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8405070-B2 Composite material, and light emitting element and light emitting device using the composite material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-03-26 US disclosed
US-8362474-B2 Organic field effect transistor and semiconductor device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-01-29 US disclosed
US-20120032160-A1 ORGANIC FIELD EFFECT TRANSISTOR AND SEMICONDUCTOR DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-02-09 US disclosed
US-8049206-B2 Organic field effect transistor and semiconductor device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2011-11-01 US disclosed
US-20100084645-A1 COMPOSITE MATERIAL, AND LIGHT EMITTING ELEMENT AND LIGHT EMITTING DEVICE USING THE COMPOSITE MATERIAL SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2010-04-08 US disclosed
US-7649197-B2 Composite material, and light emitting element and light emitting device using the composite material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2010-01-19 US disclosed
US-20090309093-A1 COMPOSITE MATERIAL, AND LIGHT EMITTING ELEMENT AND LIGHT EMITTING DEVICE USING THE COMPOSITE MATERIAL SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2009-12-17 US disclosed
US-20080254318-A1 Carbazole Derivative, and Light-Emitting Element and Light-Emitting Device Using the Carbzole Derivative SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-10-16 US disclosed
US-20080099757-A1 Organic field effect transistor and semiconductor device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-05-01 US disclosed
US-20070031701-A1 Carbazole derivative, light-emitting element material obtained by using carbazole derivative, light-emitting element, and electronic device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2007-02-08 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 (2 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-20070031701-A1 Carbazole derivative, light-emitting element material obtained by using carbazole derivative, light-emitting element, and electronic device CYP1A1, GRIA1, GNA11 MMP2 4800/4885MMP9 4282/4885MMP13 4598/4885
US-20080254318-A1 Carbazole Derivative, and Light-Emitting Element and Light-Emitting Device Using the Carbzole Derivative CYP2C19, CYP3A5, CYP3A4 MMP2 2990/4885MMP9 1547/4885MMP13 2820/4885

“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.