SCHEMBL15399737

SCHEMBL15399737

Cc1sccc1-c1cccc(Nc2ccccc2-c2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.39
SIRT2 Q8IXJ6 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
MEN1 O00255 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
RECQL P46063 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
BRD4 O60885 1/20 0.37
FABP3 P05413 1/20 0.37
FABP4 P15090 1/20 0.37
FABP5 Q01469 1/20 0.37
ALDH1A1 P00352 3/20 0.37
AR P10275 1/20 0.37
ADRA2A P08913 1/20 0.36
HTR7 P34969 1/20 0.36
ADRA1A P35348 1/20 0.36

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
SCHEMBL15605372 0.82 FABP3 (0.46) KDM4EFABP3FABP4FABP5ALDH1A1
SCHEMBL4946429 0.81 CNR1 (0.48) NPSR1SIRT2SIRT1MEN1MAPT
SCHEMBL2790237 0.78 SIRT2 (0.57) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL31029800 0.78 SIRT2 (0.57) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL25354337 0.78 MEN1 (0.54) NPSR1SIRT2SIRT1MEN1MAPT
SCHEMBL17246942 0.77 NPSR1 (0.61) NPSR1MEN1MAPTKMT2AKDM4E
SCHEMBL16838865 0.77 ALDH1A1 (0.50) NPSR1SIRT2SIRT1MEN1MAPT
SCHEMBL24672226 0.77 ALDH1A1 (0.50) NPSR1SIRT2SIRT1MEN1MAPT
SCHEMBL24958544 0.77 MEN1 (0.50) SIRT2SIRT1MEN1MAPTKMT2A
SCHEMBL17246941 0.77 NPSR1 (0.56) NPSR1MEN1MAPTKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3260458-B1 POLYCYCLIC AROMATIC COMPOUND UNIV KYOTO (JP) 2019-09-18 EP disclosed
US-20190214575-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE JNC CORPORATION (JP) 2019-07-11 US disclosed
US-20180047913-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE JNC CORPORATION (JP) 2018-02-15 US disclosed
EP-3260458-A1 POLYCYCLIC AROMATIC COMPOUND KYOTO UNIVERSITY (JP) 2017-12-27 EP disclosed
EP-2752418-B1 POLYCYCLIC AROMATIC COMPOUND UNIV KYOTO (JP) 2017-11-29 EP disclosed
US-9741950-B2 Polycyclic aromatic compound KYOTO UNIVERSITY (JP) 2017-08-22 US disclosed
US-20160049600-A1 POLYCYCLIC AROMATIC COMPOUND SK MATERIALS JNC CO., LTD. (KR) 2016-02-18 US disclosed
US-9166176-B2 Polycyclic aromatic compound KYOTO UNIVERSITY (JP) 2015-10-20 US disclosed
EP-2897184-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE JNC Corporation (JP) 2015-07-22 EP disclosed
US-20150097162-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE JNC CORPORATION (JP) 2015-04-09 US disclosed
EP-2752418-A1 POLYCYCLIC AROMATIC COMPOUND Kyoto University (JP) 2014-07-09 EP disclosed
US-20140005399-A1 POLYCYCLIC AROMATIC COMPOUND KYOTO UNIVERSITY (JP) 2014-01-02 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 (3 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-20180047913-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE L1CAM, VDAC1, VDAC2 NPSR1 3141/4885SIRT2 3998/4885SIRT1 4368/4885
US-20190214575-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND LIGHTING DEVICE L1CAM, VDAC1, VDAC2 NPSR1 3141/4885SIRT2 3998/4885SIRT1 4368/4885
US-20160049600-A1 POLYCYCLIC AROMATIC COMPOUND BICRA, PAH, SMARCC2 NPSR1 1990/4885SIRT2 2482/4885SIRT1 2603/4885

“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.