SCHEMBL63585

SCHEMBL63585

Cc1nc2ccccc2n1-c1nc(-n2c(C)nc3ccccc32)nc(-n2c(C)nc3ccccc32)n1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.71
MAPK1 P28482 2/20 0.71
PIK3CD O00329 1/20 0.68
PIK3CA P42336 1/20 0.68
PIK3CB P42338 1/20 0.68
PIK3CG P48736 1/20 0.68
TSHR P16473 3/20 0.67
RAB9A P51151 4/20 0.50
LMNA P02545 3/20 0.50
NPC1 O15118 2/20 0.50
GALR3 O60755 2/20 0.50
NR2F2 P24468 2/20 0.50
TNF P01375 1/20 0.50
KDM4E B2RXH2 1/20 0.50
TP53 P04637 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
HSD17B10 Q99714 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 2/20 0.47

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
SCHEMBL16687529 0.88 MAPK1 (0.62) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL6178078 0.87 HTT (0.61) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL21959269 0.87 HTT (0.61) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL13719133 0.86 HTT (0.56) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL19486460 0.85 TSHR (0.82) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL6180401 0.84 HTT (0.57) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL13826722 0.83 HTT (0.67) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL540947 0.83 MAPK1 (1.00) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL13030954 0.83 HTT (0.79) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL13080878 0.83 TSHR (0.73) HTTMAPK1PIK3CDPIK3CAPIK3CB

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 172 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3211056-B1 COMPOUNDS FOR USE IN OPTO-ELECTRICAL DEVICES CDT OXFORD LTD (GB) 2020-07-22 EP disclosed
US-10411212-B2 Organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2019-09-10 US disclosed
US-10361387-B2 Light emitting layer-forming solid material, organic electroluminescent device and method for producing the same UDC IRELAND LIMITED (IE) 2019-07-23 US disclosed
US-9860960-B2 Organic EL display device and method for production of the same JOLED INC. (JP) 2018-01-02 US disclosed
US-20170271607-A1 DISPLAY DEVICE, DISPLAY UNIT, AND ELECTRONIC APPARATUS JOLED INC (JP) 2017-09-21 US disclosed
US-20170271607-A1 DISPLAY DEVICE, DISPLAY UNIT, AND ELECTRONIC APPARATUS JOLED INC (JP) 2017-09-21 US disclosed
US-9680110-B2 Compounds for use in opto-electrical devices CDT OXFORD LIMITED (GB) 2017-06-13 US disclosed
US-9680110-B2 Compounds for use in opto-electrical devices CDT OXFORD LIMITED (GB) 2017-06-13 US disclosed
US-20160072089-A1 Light Emitting Layer-Forming Solid Material, Organic Electroluminescent Device And Method For Producing The Same UDC IRELAND LTD (IE) 2016-03-10 US disclosed
US-20160072089-A1 Light Emitting Layer-Forming Solid Material, Organic Electroluminescent Device And Method For Producing The Same UDC IRELAND LTD (IE) 2016-03-10 US disclosed
US-20070114919-A1 Organic electroluminescence device FUJIFILM CORPORATION 2007-05-24 US disclosed
US-20070114919-A1 Organic electroluminescence device FUJIFILM CORPORATION 2007-05-24 US disclosed
US-20070099024-A1 Electrolumiscent device UDC IRELAND LIMITED (IE) 2007-05-03 US disclosed
US-20070099024-A1 Electrolumiscent device UDC IRELAND LIMITED (IE) 2007-05-03 US disclosed
US-7211336-B2 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2007-05-01 US disclosed
US-7211336-B2 Organic electroluminescent device FUJIFILM CORPORATION (JP) 2007-05-01 US disclosed
US-20070090756-A1 Organic electroluminescent element FUJIFILM CORPORATION (JP) 2007-04-26 US disclosed
US-20070090756-A1 Organic electroluminescent element FUJIFILM CORPORATION (JP) 2007-04-26 US disclosed
US-20070057630-A1 Organic electroluminescent element FUJI PHOTO FILM CO., LTD. 2007-03-15 US disclosed
US-20070057630-A1 Organic electroluminescent element FUJI PHOTO FILM CO., LTD. 2007-03-15 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-10411212-B2 Organic electroluminescent element L1CAM, NES, EML4 HTT 4760/4885MAPK1 1256/4885PIK3CD 3975/4885

“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.