SCHEMBL18564656

SCHEMBL18564656

CN(c1ccccc1)c1ccc(-c2ccc3c4c5ccccc5ccc4n(-c4ccccc4)c3c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
MAT2A P31153 3/20 0.33
KDM4E B2RXH2 2/20 0.33
PRMT5 O14744 2/20 0.33
ATM Q13315 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GFER P55789 1/20 0.33
FAAH O00519 1/20 0.32
REN P00797 1/20 0.32
ITK Q08881 1/20 0.32
CYP1A2 P05177 1/20 0.31
MAOB P27338 1/20 0.31
PDE5A O76074 2/20 0.31
CHKA P35790 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
AVPR1A P37288 1/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL18564659 1.00 SIRT2 (0.34) SIRT2SIRT1MAT2AKDM4EPRMT5
SCHEMBL18564785 0.96 MAOB (0.33) SIRT2SIRT1MAT2APRMT5FAAH
SCHEMBL18564835 0.96 MAOB (0.33) SIRT2SIRT1MAT2APRMT5FAAH
SCHEMBL18564899 0.94 OPRD1 (0.34) SIRT2SIRT1ALDH1A1FAAHITK
SCHEMBL18564910 0.94 OPRD1 (0.34) SIRT2SIRT1ALDH1A1FAAHITK
SCHEMBL19735340 0.93 ITK (0.34) SIRT2SIRT1MAT2AKDM4EPRMT5
SCHEMBL18565000 0.92 MAPK10 (0.34) ALDH1A1FAAHITKHPGDRAB9A
SCHEMBL18565005 0.92 MAPK10 (0.34) ALDH1A1FAAHITKHPGDRAB9A
SCHEMBL18564738 0.92 ITK (0.35) MAT2AKDM4EPRMT5ATML3MBTL1
SCHEMBL18564755 0.92 KDM4E (0.37) SIRT2SIRT1KDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2019-05-14 US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 US disclosed
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2017-03-02 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 (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-10290815-B2 Composition, compound, material for organic electroluminescence element, ink composition, organic electroluminescence element, and electronic device EED, BMI1, CD99 SIRT2 3945/4885SIRT1 4400/4885MAT2A 2816/4885
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE EED, BMI1, CD99 SIRT2 3945/4885SIRT1 4400/4885MAT2A 2816/4885

“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.