SCHEMBL18564870

SCHEMBL18564870

CN(c1ccccc1)c1ccc(-c2ccc(-c3ccc4c5c6ccccc6c6ccccc6c5n(-c5ccc(-c6ccccc6)cc5)c4c3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 1/20 0.34
▸ LIMK1 P53667 1/20 0.32
▸ CHKA P35790 4/20 0.32
▸ KHK P50053 3/20 0.32
▸ OPRD1 P41143 1/20 0.32
▸ PDE5A O76074 2/20 0.32
▸ AVPR1A P37288 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GFER P55789 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ RXRA P19793 1/20 0.30
▸ RXRB P28702 1/20 0.30
▸ REN P00797 1/20 0.30
▸ CHKB Q9Y259 1/20 0.30
▸ ITK Q08881 1/20 0.30

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
SCHEMBL18564777 1.00 MAOB (0.34) MAOBLIMK1CHKAKHKOPRD1
SCHEMBL18564815 0.96 KDM4E (0.34) MAOBLIMK1CHKAKHKOPRD1
SCHEMBL18564751 0.96 KDM4E (0.34) MAOBLIMK1CHKAKHKOPRD1
SCHEMBL18564841 0.95 ITK (0.34) CHKAPDE5AKDM4EALDH1A1GFER
SCHEMBL18564904 0.93 OPRD1 (0.37) MAOBLIMK1CHKAKHKOPRD1
SCHEMBL18564911 0.93 OPRD1 (0.37) MAOBLIMK1CHKAKHKOPRD1
SCHEMBL18564797 0.90 TSPO (0.36) CHKAPDE5AKDM4ERENITK
SCHEMBL18564830 0.90 TSPO (0.36) CHKAPDE5AKDM4ERENITK
SCHEMBL18565016 0.90 MAPK10 (0.33) OPRD1ITK
SCHEMBL18565023 0.90 MAPK10 (0.33) OPRD1ITK

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 MAOB 760/4885LIMK1 16/4885CHKA 2310/4885
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE EED, BMI1, CD99 MAOB 760/4885LIMK1 16/4885CHKA 2310/4885

“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.

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