SCHEMBL19104486

SCHEMBL19104486

CC1(C)c2ccccc2-c2cc3c(cc21)c1cc(-c2ccc4c(c2)c2ccccc2n4-c2ccccc2)ccc1n3-c1nc(-c2ccccc2)nc(-c2cccc(-c3ccccc3)c2)n1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TSPO P30536 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
SCHEMBL19104505 0.96 PTGER4 (0.33) PTGER4KDM4EATML3MBTL1TSPO
SCHEMBL12952493 0.96 KDM4E (0.35) PTGER4KDM4EATML3MBTL1TSPO
SCHEMBL8815488 0.96 KDM4E (0.35) PTGER4KDM4EATML3MBTL1TSPO
SCHEMBL2603606 0.96 KDM4E (0.35) PTGER4KDM4EATML3MBTL1
SCHEMBL15805986 0.95 PTGER4 (0.34) PTGER4KDM4EATML3MBTL1TSPO
SCHEMBL17246706 0.95 PTGER4 (0.35) PTGER4KDM4EATML3MBTL1TSPO
SCHEMBL15806101 0.94 PTGER4 (0.34) PTGER4KDM4EATML3MBTL1
SCHEMBL25965944 0.94 CAMK2D (0.32) KDM4EATM
SCHEMBL17246691 0.94 PTGER4 (0.34) PTGER4KDM4EATML3MBTL1
SCHEMBL23317942 0.94 PTGER4 (0.35) PTGER4KDM4EATML3MBTL1TSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170200904-A1 AN ORGANIC ELECTROLUMINESCENT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-07-13 — — US disclosed
US-20170200904-A1 AN ORGANIC ELECTROLUMINESCENT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2017-07-13 — — 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-20170200904-A1 AN ORGANIC ELECTROLUMINESCENT COMPOUND AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME TERT, ODC1, ESD PTGER4 3430/4885KDM4E 815/4885ATM 3480/4885

“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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