SCHEMBL19500758

SCHEMBL19500758

CC1(C)c2ccccc2-c2ccc(-n3c4ccccc4c4cc(-c5ccc(-c6ccc7c(c6)c6ccccc6n7-c6ccc7cc(-c8ccccc8)ccc7c6)cc5)ccc43)cc21

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 4/20 0.35
▸ PDK2 Q15119 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ RAC2 P15153 1/20 0.32
▸ RAC3 P60763 1/20 0.32
▸ CDC42 P60953 1/20 0.32
▸ RAC1 P63000 1/20 0.32
▸ NPY5R Q15761 1/20 0.31
▸ NR3C1 P04150 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ PGR P06401 1/20 0.30
▸ GSK3B P49841 1/20 0.30
▸ RXRA P19793 1/20 0.30
▸ RXRB P28702 1/20 0.30
▸ PTGER4 P35408 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
SCHEMBL19500792 0.97 TSPO (0.33) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL19500777 0.97 TSPO (0.33) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL19500768 0.94 TUBB4A (0.32) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL13443595 0.94 TUBB4A (0.33) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL24568155 0.94 TSPO (0.38) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL15480240 0.94 TSPO (0.38) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL30860129 0.94 TSPO (0.38) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL19500803 0.94 RXRA (0.34) PDK2KDM4EATML3MBTL1HDAC4
SCHEMBL15480078 0.94 KDM4E (0.39) TSPOPDK2KDM4EATML3MBTL1
SCHEMBL16804120 0.93 PDK2 (0.34) PDK2NR3C1ESR1ESR2PGR

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-10633583-B2 Organic electroluminescent compounds and an organic electroluminescent device comprising the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2020-04-28 — — US disclosed
US-20170305854-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-10-26 — — US disclosed
US-20170305854-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2017-10-26 — — 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-20170305854-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND AN ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME OTC, TELO2, TERT TSPO 565/4885PDK2 815/4885KDM4E 780/4885
US-10633583-B2 Organic electroluminescent compounds and an organic electroluminescent device comprising the same ELAVL1, OTC, SOD1 TSPO 711/4885PDK2 747/4885KDM4E 906/4885

“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.

Send feedback