SCHEMBL970946

SCHEMBL970946

c1ccc(-c2ccccc2-c2c3ccccc3c(-c3ccc(-c4cn5ccccc5n4)cc3)c3ccccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 12/20 0.56
NPC1 O15118 11/20 0.56
KDM4E B2RXH2 9/20 0.56
POLB P06746 2/20 0.56
GFER P55789 3/20 0.55
PKM P14618 5/20 0.52
EPHX2 P34913 1/20 0.52
ALDH1A3 P47895 5/20 0.50
ALDH1A2 O94788 3/20 0.50
HDAC6 Q9UBN7 1/20 0.50
ALDH1A1 P00352 7/20 0.49
SMN1; SMN2 Q16637 6/20 0.49
MAPK1 P28482 3/20 0.49
PTGS1 P23219 1/20 0.49
PTGS2 P35354 1/20 0.49
MEN1 O00255 1/20 0.49
GAA P10253 1/20 0.49
MIF P14174 1/20 0.49
KMT2A Q03164 1/20 0.49
MAPT P10636 3/20 0.48

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
SCHEMBL971632 0.92 RAB9A (0.65) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL13454308 0.90 RAB9A (0.63) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL13454281 0.89 RAB9A (0.69) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL13553111 0.89 RAB9A (0.69) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL13553106 0.87 RAB9A (0.67) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL19558235 0.87 ALDH1A3 (0.54) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL972479 0.87 RAB9A (0.56) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL971874 0.85 RAB9A (0.57) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL13454265 0.85 RAB9A (0.51) RAB9ANPC1KDM4EPOLBGFER
SCHEMBL13454261 0.85 RAB9A (0.53) RAB9ANPC1KDM4EPOLBGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180102483-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOUND AND MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, USED IN THE SAME, AND LIGHT EMITTING DEVICE, DISPLAY DEVICE AND ILLUMINATION DEVICE, USING THE ELEMENT UDC IRELAND LTD (IE) 2018-04-12 US disclosed
US-9812650-B2 Organic electroluminescent element, compound and material for organic electroluminescent element, used in the same, and light emitting device, display device and illumination device, using the element UDC IRELAND LIMITED (IE) 2017-11-07 US disclosed
US-9812650-B2 Organic electroluminescent element, compound and material for organic electroluminescent element, used in the same, and light emitting device, display device and illumination device, using the element UDC IRELAND LIMITED (IE) 2017-11-07 US disclosed
US-9728726-B2 Organic electroluminescent element, material for organic electroluminescent element and light emitting device, display device, and illumination device, each employing organic electroluminescent element UDC IRELAND LIMITED (IE) 2017-08-08 US disclosed
US-9728726-B2 Organic electroluminescent element, material for organic electroluminescent element and light emitting device, display device, and illumination device, each employing organic electroluminescent element UDC IRELAND LIMITED (IE) 2017-08-08 US disclosed
US-9608207-B2 Organic electroluminescence element UDC IRELAND LIMITED (IE) 2017-03-28 US disclosed
US-9608207-B2 Organic electroluminescence element UDC IRELAND LIMITED (IE) 2017-03-28 US disclosed
US-20150076462-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOUND AND MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, USED IN THE SAME, AND LIGHT EMITTING DEVICE, DISPLAY DEVICE AND ILLUMINATION DEVICE, USING THE ELEMENT UDC IRELAND LIMITED (IE) 2015-03-19 US disclosed
US-20150076462-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOUND AND MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, USED IN THE SAME, AND LIGHT EMITTING DEVICE, DISPLAY DEVICE AND ILLUMINATION DEVICE, USING THE ELEMENT UDC IRELAND LIMITED (IE) 2015-03-19 US disclosed
US-20140299851-A1 Organic Electroluminescence Element UDC IRELAND LIMITED (IE) 2014-10-09 US disclosed
US-20140299851-A1 Organic Electroluminescence Element UDC IRELAND LIMITED (IE) 2014-10-09 US disclosed
US-20140291660-A1 Organic Electroluminescent Element, Material for Organic Electroluminescent Element and Light Emitting Device, Display Device, and Illumination Device, Each Employing Organic Electroluminescent Element UDC IRELAND LIMITED (IE) 2014-10-02 US disclosed
US-20140291660-A1 Organic Electroluminescent Element, Material for Organic Electroluminescent Element and Light Emitting Device, Display Device, and Illumination Device, Each Employing Organic Electroluminescent Element UDC IRELAND LIMITED (IE) 2014-10-02 US disclosed
EP-1582516-B1 Nitrogenous heterocyclic derivative and organic electroluminescent element employing the same IDEMITSU KOSAN CO (JP) 2013-07-17 EP disclosed
US-7867629-B2 Nitrogenous heterocyclic derivative and organic electroluminescent element employing the same IDEMITSU KOSAN CO., LTD. (JP) 2011-01-11 US disclosed
US-20060154105-A1 Nitrogenous heterocyclic derivative and organic elecrtroluminescent element employing the same IDEMITSU KOSAN CO., LTD. (JP) 2006-07-13 US disclosed
EP-1582516-A1 NITROGENOUS HETEROCYCLIC DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT EMPLOYING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2005-10-05 EP 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-20180102483-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOUND AND MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, USED IN THE SAME, AND LIGHT EMITTING DEVICE, DISPLAY DEVICE AND ILLUMINATION DEVICE, USING THE ELEMENT RPS10, RPS20, RPS19 RAB9A 851/4885NPC1 4256/4885KDM4E 1007/4885
US-20060154105-A1 Nitrogenous heterocyclic derivative and organic elecrtroluminescent element employing the same L1CAM, NOTCH1, NUDC RAB9A 2094/4885NPC1 4231/4885KDM4E 2066/4885

“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.