SCHEMBL14330697

SCHEMBL14330697

c1ccc(N(c2ccc(-c3cccc4c3sc3ccccc34)cc2)c2ccc(-c3nc4ccccc4n3-c3ccccc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.42
ESR2 Q92731 2/20 0.42
RECQL P46063 1/20 0.40
GRIA1 P42261 1/20 0.39
CACNG8 Q8WXS5 1/20 0.39
CACNG2 Q9Y698 1/20 0.39
ALOX5 P09917 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.38
SIRT1 Q96EB6 1/20 0.38
HTT P42858 4/20 0.36
MAPK1 P28482 1/20 0.36
PTGS2 P35354 1/20 0.36
PTGER4 P35408 1/20 0.36
ALDH1A1 P00352 5/20 0.35
MAPT P10636 3/20 0.35
RAB9A P51151 3/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 2/20 0.35

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
SCHEMBL430153 0.93 ESR1 (0.48) ESR1ESR2RECQLGRIA1CACNG8
SCHEMBL30350267 0.93 ESR1 (0.48) ESR1ESR2RECQLGRIA1CACNG8
SCHEMBL12349385 0.89 ESR2 (0.52) ESR1ESR2RECQLGRIA1CACNG8
SCHEMBL12349149 0.86 ESR1 (0.44) ESR1ESR2RECQLGRIA1CACNG8
SCHEMBL12349379 0.85 ESR2 (0.45) ESR1ESR2RECQLGRIA1CACNG8
SCHEMBL12567866 0.85 ALDH1A1 (0.46) ESR1ESR2RECQLGRIA1CACNG8
SCHEMBL1999345 0.85 ESR1 (0.54) ESR1ESR2RECQLGRIA1CACNG8
SCHEMBL17856686 0.84 ESR1 (0.41) ESR1ESR2RECQLGRIA1CACNG8
SCHEMBL17856752 0.84 ESR1 (0.41) ESR1ESR2RECQLGRIA1CACNG8
SCHEMBL461927 0.84 ESR1 (0.46) ESR1ESR2RECQLGRIA1CACNG8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9525143-B2 Triarylamine compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-12-20 US disclosed
US-9525143-B2 Triarylamine compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2016-12-20 US disclosed
US-20150280135-A1 Triarylamine Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-10-01 US disclosed
US-20150280135-A1 Triarylamine Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-10-01 US disclosed
US-9051274-B2 Triarylamine compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-06-09 US disclosed
US-9051274-B2 Triarylamine compound, light-emitting element, light-emitting device, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2015-06-09 US disclosed
US-20120330025-A1 Triarylamine Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-12-27 US disclosed
US-20120330025-A1 Triarylamine Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2012-12-27 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-20120330025-A1 Triarylamine Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SLC6A3, SLC6A2, SLC18A2 ESR1 1373/4885ESR2 1971/4885RECQL 2260/4885
US-20150280135-A1 Triarylamine Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SLC6A3, SLC6A2, SLC18A2 ESR1 1373/4885ESR2 1971/4885RECQL 2260/4885

“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.