SCHEMBL17759871

SCHEMBL17759871

CC1(C)c2ccccc2-c2ccc3c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccccc6)cc5)ccc4n(-c4ccc(-c5ccccc5)cc4)c3c21

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TSPO P30536 2/20 0.34
HDAC4 P56524 1/20 0.34
PDK2 Q15119 2/20 0.33
DUSP3 P51452 1/20 0.32
PTGER4 P35408 1/20 0.32

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
SCHEMBL19653533 0.99 KDM4E (0.38) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL19653457 0.99 KDM4E (0.38) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL15583032 0.98 KDM4E (0.38) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL15582915 0.98 KDM4E (0.38) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL19653630 0.97 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL19653563 0.97 KDM4E (0.36) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL17759387 0.96 KDM4E (0.37) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL17759699 0.96 KDM4E (0.37) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL15338026 0.96 KDM4E (0.40) KDM4EATML3MBTL1TSPOHDAC4
SCHEMBL17691665 0.95 KDM4E (0.38) KDM4EATML3MBTL1TSPOPDK2

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-11130747-B2 Plurality of host materials and an organic electroluminescence device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD (KR) 2021-09-28 US disclosed
US-20170342057-A1 A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-11-30 US disclosed
US-20170342057-A1 A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-11-30 US disclosed
WO-2016076629-A1 A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2016-05-19 WO 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-11130747-B2 Plurality of host materials and an organic electroluminescence device comprising the same SOD1, TERT, TELO2 KDM4E 2736/4885ATM 3138/4885L3MBTL1 59/4885
US-20170342057-A1 A PLURALITY OF HOST MATERIALS AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE SAME TERT, TELO2, SOD1 KDM4E 2915/4885ATM 3046/4885L3MBTL1 37/4885

“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.