SCHEMBL22858087

SCHEMBL22858087

CC(C)c1ccc(-c2ccc3c(c2)c2cccc4c5c6ccccc6ccc5n3c24)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.35
GAA P10253 1/20 0.33
PTPN5 P54829 1/20 0.33
DHODH Q02127 2/20 0.33
PTGES O14684 1/20 0.32
PDE10A Q9Y233 1/20 0.32
TNKS O95271 1/20 0.32
PARP1 P09874 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
PARP2 Q9UGN5 1/20 0.32
AKR1B1 P15121 1/20 0.32
PHGDH O43175 1/20 0.32
RORA P35398 1/20 0.32
RORC P51449 1/20 0.32
RORB Q92753 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
PAX8 Q06710 1/20 0.32
NOD2 Q9HC29 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
SCHEMBL21718096 0.90 RORA (0.39) GAAAKR1B1PHGDHRORARORC
SCHEMBL21710486 0.89 NTSR1 (0.32) PIK3CDAKR1B1AKR1C3AKR1C2
SCHEMBL21710478 0.88 PTGES (0.34) PIK3CDGAADHODHPTGESTNKS
SCHEMBL22858105 0.87 PTGES (0.35) PTGESMAPTRAB9APAX8HSD17B1
SCHEMBL21718134 0.87 PTGES (0.35) PTGESMAPTRAB9APAX8HSD17B1
SCHEMBL21710721 0.86 PTPN5 (0.35) PIK3CDGAAPTPN5DHODHTNKS
SCHEMBL22858086 0.86 PTGES (0.35) PTGESMAPTRAB9APAX8HSD17B1
SCHEMBL21710462 0.86 MAPT (0.38) PTPN5DHODHTNKSPARP1TNKS2
SCHEMBL21718136 0.85 PTGES (0.34) PTGESMAPTRAB9APAX8HSD17B1
SCHEMBL21710485 0.84 HPRT1 (0.36) PTGESMAPTRAB9AL3MBTL1HSD17B1

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-11723272-B2 Organic electroluminescence element and electronic device IDEMITSU KOSAN CO., LTD. (JP) 2023-08-08 US disclosed
US-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2021-01-07 US disclosed
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS IDEMITSU KOSAN CO., LTD. (JP) 2021-01-07 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-20210005825-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE OR51E2, CD99, CTNND1 PIK3CD 3584/4885GAA 2166/4885PTPN5 4709/4885
US-20210005826-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT AND ELECTRONIC APPARATUS EML4, EBPL, LEF1 PIK3CD 4476/4885GAA 1829/4885PTPN5 4747/4885

“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.