SCHEMBL18564883

SCHEMBL18564883

CN(c1ccccc1)c1ccc(-c2ccc3c4ccccc4n(-c4cccc(-c5ccccc5)c4)c3c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.44
KDM4E B2RXH2 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
OPRD1 P41143 2/20 0.38
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
CHKA P35790 3/20 0.36
REN P00797 1/20 0.36
TSPO P30536 2/20 0.35
ALDH1A1 P00352 2/20 0.34
FAAH O00519 1/20 0.34
HSP90AA1 P07900 1/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.34
MGLL Q99685 1/20 0.34
USP2 O75604 2/20 0.34
CYP2C9 P11712 2/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HSD17B10 Q99714 2/20 0.34

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
SCHEMBL18564889 1.00 ATM (0.44) ATMKDM4EL3MBTL1OPRD1RXRA
SCHEMBL18564869 0.95 ATM (0.44) ATMKDM4EL3MBTL1OPRD1CHKA
SCHEMBL18564745 0.93 KDM4E (0.51) ATMKDM4EL3MBTL1RXRARXRB
SCHEMBL18564665 0.93 KDM4E (0.51) ATMKDM4EL3MBTL1RXRARXRB
SCHEMBL19735350 0.93 KDM4E (0.51) ATMKDM4EL3MBTL1OPRD1RXRA
SCHEMBL18564930 0.92 ATM (0.44) ATMKDM4EL3MBTL1OPRD1CHKA
SCHEMBL18564933 0.92 ATM (0.44) ATMKDM4EL3MBTL1OPRD1CHKA
SCHEMBL18564765 0.92 KDM4E (0.46) ATMKDM4EL3MBTL1RXRARXRB
SCHEMBL18564820 0.92 KDM4E (0.46) ATMKDM4EL3MBTL1RXRARXRB
SCHEMBL18079902 0.91 ATM (0.42) ATMKDM4EL3MBTL1OPRD1CHKA

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 ATM 3092/4885KDM4E 225/4885L3MBTL1 1263/4885
US-20170062733-A1 COMPOSITION, COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, INK COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE EED, BMI1, CD99 ATM 3092/4885KDM4E 225/4885L3MBTL1 1263/4885

“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.