SCHEMBL3466482

SCHEMBL3466482

c1ccc(C2(c3ccccc3)Cc3ccccc3N2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.39
MAPT P10636 3/20 0.37
NPC1 O15118 2/20 0.36
KDM4E B2RXH2 2/20 0.36
AHR P35869 1/20 0.36
PDK2 Q15119 1/20 0.36
MEN1 O00255 1/20 0.36
HSP90AA1 P07900 1/20 0.36
THRB P10828 1/20 0.36
HK1 P19367 1/20 0.36
MAPK1 P28482 1/20 0.36
RECQL P46063 1/20 0.36
RAB9A P51151 1/20 0.36
GALK1 P51570 1/20 0.36
BLM P54132 1/20 0.36
KMT2A Q03164 1/20 0.36
HKDC1 Q2TB90 1/20 0.36
MAPK13 O15264 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 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
SCHEMBL21143033 0.78 MAPT (0.38) MAPTNPC1KDM4EAHRPDK2
SCHEMBL11832782 0.75 KDM4E (0.41) NPY5RMAPTNPC1KDM4EMEN1
SCHEMBL3724373 0.71 BACE1 (0.46) NPY5RMAPTMEN1BLMKMT2A
SCHEMBL29094430 0.71 PDPK1 (0.40) NPY5RLDHALDHB
SCHEMBL1119036 0.70 GAA (0.46) MAPTNPC1KDM4EAHRPDK2
SCHEMBL6773172 0.69 BRD4 (0.42) MAPTNPC1KDM4EAHRPDK2
SCHEMBL5837737 0.69 BRD4 (0.42) MAPTNPC1KDM4EAHRPDK2
SCHEMBL28361036 0.68 MAPT (0.38) MAPTNPC1KDM4EAHRPDK2
SCHEMBL23714201 0.67 HTR5A (0.37) MAPTNPC1KDM4EAHRPDK2
SCHEMBL31059284 0.67 HTR5A (0.37) MAPTNPC1KDM4EAHRPDK2

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
EP-2169028-B1 Material for organic electroluminescent devices and organic electroluminescent devices made by using the same IDEMITSU KOSAN CO (JP) 2018-11-21 EP disclosed
CN-106848072-A Organic illuminating element 东进世美肯株式会社 2017-06-13 CN disclosed
CN-106573905-A Novel compound and orgarnic light emitting device containing same 东进世美肯株式会社 2017-04-19 CN disclosed
US-8741450-B2 Material for organic electroluminescence devices and organic electroluminescence device using the material IDEMITSU KOSAN CO., LTD. (JP) 2014-06-03 US disclosed
US-8580391-B2 Material for organic electroluminescence devices and organic electroluminescence device using the material IDEMITSU KOSAN CO., LTD. (JP) 2013-11-12 US disclosed
US-20120319099-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICES AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE MATERIAL IDEMITSU KOSAN CO., LTD. (JP) 2012-12-20 US disclosed
US-20120298975-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICES AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE MATERIAL IDEMITSU KOSAN CO., LTD. (JP) 2012-11-29 US disclosed
EP-2169028-A2 Material for organic electroluminescent devices and organic electroluminescent devices made by using the same Idemitsu Kosan Co., Ltd. (JP) 2010-03-31 EP disclosed
US-20050249976-A1 Material for organic electroluminescence devices and organic electroluminescence device using the material IDEMITSU KOSAN CO., LTD. (JP) 2005-11-10 US disclosed
EP-1489155-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICES AND ORGANIC ELECTROLUMINESCENT DEVICES MADE BY USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2004-12-22 EP disclosed
US-20040086745-A1 Material for organic electroluminescence devices and organic electroluminescence device using the material IDEMITSU KOSAN CO., LTD. (JP) 2004-05-06 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-20120298975-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICES AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE MATERIAL EED, BMI1, EZH2 NPY5R 4406/4885MAPT 1648/4885NPC1 3318/4885
US-20120319099-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENCE DEVICES AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE MATERIAL EED, KCNB2, EZH2 NPY5R 4392/4885MAPT 1649/4885NPC1 3451/4885

“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.