SCHEMBL17829225

SCHEMBL17829225

c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc(-c5nc(-n6c7ccccc7c7cc(-c8ccc9c(c8)c8ccccc8n9-c8ccccc8)ccc76)nc6c5ccc5ccccc56)c4)ccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTGER4 P35408 1/20 0.33
NPY5R Q15761 1/20 0.33
PTGES O14684 1/20 0.32
TSPO P30536 1/20 0.30
HDAC4 P56524 1/20 0.30
EGFR P00533 1/20 0.30
ERBB2 P04626 1/20 0.30
KMT2A Q03164 1/20 0.30
IL1R1 P14778 1/20 0.30
MAOA P21397 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
SCHEMBL17904198 1.00 KDM4E (0.38) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL17829144 0.99 KDM4E (0.38) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL17904204 0.98 KDM4E (0.37) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL17904200 0.98 KDM4E (0.37) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL17828924 0.98 KDM4E (0.37) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL17904214 0.97 KDM4E (0.36) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL17904211 0.96 KDM4E (0.35) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL18058341 0.95 L3MBTL1 (0.39) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL17828941 0.95 L3MBTL1 (0.39) KDM4EATML3MBTL1HDAC4KMT2A
SCHEMBL18058336 0.95 L3MBTL1 (0.41) KDM4EATML3MBTL1PTGER4NPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9508939-B2 Compound and organic electroluminescent element produced using same IDEMITSU KOSAN CO., LTD. (JP) 2016-11-29 US disclosed
US-9508939-B2 Compound and organic electroluminescent element produced using same IDEMITSU KOSAN CO., LTD. (JP) 2016-11-29 US disclosed
US-20160172604-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT PRODUCED USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-06-16 US disclosed
US-20160172604-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT PRODUCED USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-06-16 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 (1 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-20160172604-A1 NOVEL COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT PRODUCED USING SAME L1CAM, LEF1, EML4 KDM4E 2236/4885ATM 2921/4885L3MBTL1 271/4885

“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.