SCHEMBL21396711

SCHEMBL21396711

C[Si](C)(c1ccc(-n2c3ccccc3c3ccccc32)c(C#N)c1)c1ccc(-n2c3ccccc3c3ccccc32)cn1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP14 P54578 1/20 0.34
PTGER4 P35408 1/20 0.33
IMPDH2 P12268 3/20 0.33
KDM4E B2RXH2 2/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
SLC22A12 Q96S37 2/20 0.31
RAB9A P51151 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
SCHEMBL21396689 0.88 KDM4E (0.34) USP14PTGER4IMPDH2KDM4EATM
SCHEMBL21396695 0.83 ALDH1A1 (0.36) USP14PTGER4IMPDH2KDM4EATM
SCHEMBL21396692 0.79 PTGER4 (0.37) PTGER4IMPDH2KDM4EATML3MBTL1
SCHEMBL21396982 0.76 ALDH1A1 (0.39) USP14PTGER4IMPDH2KDM4EATM
SCHEMBL21397121 0.74 SLC22A12 (0.39) USP14SLC22A12
SCHEMBL21397069 0.73 ALDH1A1 (0.39) USP14KDM4EATML3MBTL1RAB9A
SCHEMBL21396731 0.73 ALDH1A1 (0.36) USP14PTGER4IMPDH2KDM4EATM
SCHEMBL21397188 0.72 HTR6 (0.35) USP14KDM4EATML3MBTL1SLC22A12
SCHEMBL21396673 0.70 SLC6A9 (0.36) USP14PTGER4IMPDH2KDM4EATM
SCHEMBL30968745 0.69 KDM4E (0.46) IMPDH2KDM4EATML3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190296247-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2019-09-26 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 (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-20190296247-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SLC25A21, SLCO4C1, SLC18A1 USP14 3820/4885PTGER4 2404/4885IMPDH2 2606/4885

“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.