SCHEMBL22761238

SCHEMBL22761238

N#Cc1cccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc(C#N)cc5C#N)ccc43)c(C(F)(F)F)c2-n2c3ccccc3c3cc(-c4ccc(C#N)cc4C#N)ccc32)c1

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 1/20 0.35
▸ PRF1 P14222 1/20 0.34
▸ ENPP1 P22413 1/20 0.34
▸ PTPN5 P54829 1/20 0.33
▸ STS P08842 1/20 0.33
▸ AR P10275 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ GABRG2 P18507 1/20 0.31
▸ GABRB3 P28472 1/20 0.31
▸ GABRA5 P31644 1/20 0.31
▸ GABRA3 P34903 1/20 0.31
▸ PTGER4 P35408 1/20 0.31
▸ CHEK1 O14757 1/20 0.30
▸ ADRA2C P18825 1/20 0.30
▸ ALPL P05186 1/20 0.30
▸ ALPI P09923 1/20 0.30
▸ MAT2A P31153 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
SCHEMBL22761239 0.96 PDK2 (0.35) PDK2PRF1ENPP1PTPN5STS
SCHEMBL22761284 0.94 PDK2 (0.37) PDK2PRF1ENPP1PTPN5AR
SCHEMBL22761150 0.94 PDK2 (0.35) PDK2PRF1ENPP1PTPN5STS
SCHEMBL22761216 0.93 PDK2 (0.40) PDK2PRF1ENPP1PTPN5GABRG2
SCHEMBL22761153 0.93 PDK2 (0.39) PDK2PRF1ENPP1PTPN5PTGER4
SCHEMBL21546521 0.92 ENPP1 (0.37) PDK2PRF1ENPP1PTPN5CHEK1
SCHEMBL22761214 0.92 PDK2 (0.39) PDK2PRF1ENPP1PTPN5AR
SCHEMBL21547102 0.92 PDK2 (0.39) PDK2PRF1ENPP1PTPN5GABRA1
SCHEMBL22761242 0.92 PDK2 (0.39) PDK2PRF1ENPP1PTPN5GABRG2
SCHEMBL22761240 0.91 PRF1 (0.36) PDK2PRF1ENPP1PTPN5STS

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-10981930-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-20 — — US disclosed
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-10 — — 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-10981930-B2 Organic molecules for use in optoelectronic devices OR10J3, OR51E2, EPCAM PDK2 2517/4885PRF1 4364/4885ENPP1 2388/4885
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, EPCAM PDK2 2517/4885PRF1 4364/4885ENPP1 2388/4885

“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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