SCHEMBL19367131

SCHEMBL19367131

N#Cc1ccc(-c2ccccc2Oc2ccccc2-c2ccc(C#N)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 5/20 0.46
TSHR P16473 1/20 0.44
AR P10275 3/20 0.43
ALOX5AP P20292 2/20 0.43
FEN1 P39748 2/20 0.43
FYN P06241 1/20 0.43
MMP3 P08254 1/20 0.42
NCOA1 Q15788 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42
SLC6A4 P31645 1/20 0.41
PTGS1 P23219 1/20 0.41
MAOB P27338 1/20 0.41
STAT3 P40763 1/20 0.40

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
SCHEMBL27716203 0.85 NCOA1 (0.62) SCN9ATSHRARNCOA1NCOA3
SCHEMBL1436484 0.85 FYN (0.56) ARFYNMAOBSTAT3
SCHEMBL31463164 0.83 TSHR (0.57) TSHRMMP3PTGS1MAOB
SCHEMBL28421503 0.82 SCN9A (0.51) SCN9AARALOX5APFEN1NCOA1
SCHEMBL31501815 0.80 MMP3 (0.40) SCN9ATSHRARFYNMMP3
SCHEMBL4599915 0.80 FFAR4 (0.50) SCN9AARALOX5APFEN1
SCHEMBL7038780 0.80 NCOA1 (0.42) SCN9AARALOX5APFEN1NCOA1
SCHEMBL5872097 0.80 APP (0.48) SCN9AARNCOA1NCOA3
SCHEMBL9422296 0.80 SLC6A4 (0.57) TSHRARNCOA1NCOA3SLC6A4
Hydrochloric Acid SCHEMBL4599483 0.79 FFAR4 (0.49) SCN9AARALOX5APFEN1

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-20230295490-A1 LIGHT-EMITTING NANOPARTICLES AND LIGHT-EMITTING LABELING MATERIAL FOR PATHOLOGICAL DIAGNOSIS Konica Minolta, Inc. (JP) 2023-09-21 US disclosed
US-20230295490-A1 LIGHT-EMITTING NANOPARTICLES AND LIGHT-EMITTING LABELING MATERIAL FOR PATHOLOGICAL DIAGNOSIS Konica Minolta, Inc. (JP) 2023-09-21 US disclosed
US-11329234-B2 Organic electroluminescent element, display device, lighting device, π-conjugated compound, and light-emitting thin film MERCK PATENT GMBH (DE) 2022-05-10 US disclosed
WO-2021261398-A1 LIGHT-EMITTING NANOPARTICLES AND LIGHT-EMITTING LABELING MATERIAL FOR PATHOLOGICAL DIAGNOSIS コニカミノルタ株式会社 2021-12-30 WO disclosed
US-10950799-B2 Organic electroluminescent element, display device, lighting device, PI-conjugated compound, and light-emitting thin film MERCK PATENT GMBH (DE) 2021-03-16 US disclosed
US-20200044164-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM UDC IRELAND LIMITED (IE) 2020-02-06 US disclosed
US-20170271597-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM MERCK PATENT GMBH (DE) 2017-09-21 US disclosed
US-20170271597-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM MERCK PATENT GMBH (DE) 2017-09-21 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 (4 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-20200044164-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM LPO, L1CAM, INTS9 SCN9A 684/4885TSHR 4392/4885AR 3974/4885
US-10950799-B2 Organic electroluminescent element, display device, lighting device, PI-conjugated compound, and light-emitting thin film LPO, L1CAM, INTS9 SCN9A 684/4885TSHR 4392/4885AR 3974/4885
US-20170271597-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM LPO, L1CAM, INTS9 SCN9A 394/4885TSHR 4454/4885AR 3993/4885
US-11329234-B2 Organic electroluminescent element, display device, lighting device, π-conjugated compound, and light-emitting thin film LPO, L1CAM, SELE SCN9A 544/4885TSHR 4231/4885AR 3690/4885

“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.