SCHEMBL19367156

SCHEMBL19367156

c1cnc(-c2cccc(-c3ncccn3)c2N2c3ccccc3Oc3ccccc32)nc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 7/20 0.37
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
ATM Q13315 1/20 0.33
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
BRD4 O60885 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL20277216 0.85 P2RX4 (0.36) P2RX4KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL20277271 0.84 P2RX4 (0.40) P2RX4MAPTSMN1; SMN2NPSR1
SCHEMBL9100552 0.84 KDM4E (0.39) P2RX4KDM4EALDH1A1HTTHSD17B10
SCHEMBL20277300 0.81 P2RX4 (0.38) P2RX4KDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL20277146 0.81 P2RX4 (0.38) P2RX4KDM4EALDH1A1HTTHSD17B10
SCHEMBL20282447 0.81 P2RX4 (0.31) P2RX4MAPTSMN1; SMN2NPSR1BRD4
SCHEMBL9102663 0.80 TP53 (0.36) P2RX4MAPK1ALDH1A1HTTMAPT
SCHEMBL20277002 0.80 P2RX4 (0.37) P2RX4MAPTSMN1; SMN2NPSR1
SCHEMBL20277006 0.79 P2RX4 (0.39) P2RX4
SCHEMBL21045861 0.79 HTR7 (0.37) KDM4EMAPK1ALDH1A1HTTHSD17B10

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 11 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-11358951-B2 Π(PI)-conjugated compound, organic electroluminescence element material, light-emitting material, light-emitting thin film, organic electroluminescence element, display device, and illumination device MERCK PATENT GMBH (DE) 2022-06-14 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-20180170914-A1 II(PI)-CONJUGATED COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, LIGHT-EMITTING MATERIAL, LIGHT-EMITTING THIN FILM, ORGANIC ELECTROLUMINESCENCE ELEMENT, DISPLAY DEVICE, AND ILLUMINATION DEVICE Konica Minolta, Inc. (JP) 2018-06-21 US disclosed
US-20180170914-A1 II(PI)-CONJUGATED COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, LIGHT-EMITTING MATERIAL, LIGHT-EMITTING THIN FILM, ORGANIC ELECTROLUMINESCENCE ELEMENT, DISPLAY DEVICE, AND ILLUMINATION DEVICE Konica Minolta, Inc. (JP) 2018-06-21 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
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 (6 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 P2RX4 2026/4885KDM4E 3395/4885MAPK1 2242/4885
US-10950799-B2 Organic electroluminescent element, display device, lighting device, PI-conjugated compound, and light-emitting thin film LPO, L1CAM, INTS9 P2RX4 2026/4885KDM4E 3395/4885MAPK1 2242/4885
US-20180170914-A1 II(PI)-CONJUGATED COMPOUND, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, LIGHT-EMITTING MATERIAL, LIGHT-EMITTING THIN FILM, ORGANIC ELECTROLUMINESCENCE ELEMENT, DISPLAY DEVICE, AND ILLUMINATION DEVICE OCIAD2, ZYX, OCIAD1 P2RX4 4477/4885KDM4E 2506/4885MAPK1 574/4885
US-20170271597-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, LIGHTING DEVICE, PI-CONJUGATED COMPOUND, AND LIGHT-EMITTING THIN FILM LPO, L1CAM, INTS9 P2RX4 2250/4885KDM4E 3676/4885MAPK1 2301/4885
US-11329234-B2 Organic electroluminescent element, display device, lighting device, π-conjugated compound, and light-emitting thin film LPO, L1CAM, SELE P2RX4 2143/4885KDM4E 2979/4885MAPK1 2436/4885
US-11358951-B2 Π(PI)-conjugated compound, organic electroluminescence element material, light-emitting material, light-emitting thin film, organic electroluminescence element, display device, and illumination device ZYX, OCIAD2, DRD1 P2RX4 4048/4885KDM4E 2680/4885MAPK1 540/4885

“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.