SCHEMBL21547047

SCHEMBL21547047

N#Cc1cccc(-c2ccc(-n3c4cc(C#N)ccc4c4ccc(C#N)cc43)c(C(F)(F)F)c2-n2c3cc(C#N)ccc3c3ccc(C#N)cc32)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PRF1 P14222 2/20 0.38
▸ ENPP1 P22413 1/20 0.38
▸ PDK2 Q15119 1/20 0.37
▸ PTGDR2 Q9Y5Y4 1/20 0.34
▸ PTPN5 P54829 1/20 0.34
▸ CETP P11597 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ ADRA2C P18825 1/20 0.33
▸ ALPL P05186 1/20 0.33
▸ ALPI P09923 1/20 0.33
▸ CLK4 Q9HAZ1 1/20 0.33
▸ MAT2A P31153 1/20 0.32
▸ SYK P43405 2/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ CNR1 P21554 1/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ RORC P51449 1/20 0.32
▸ TRPA1 O75762 1/20 0.31
▸ LRRK2 Q5S007 1/20 0.31

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
SCHEMBL21546524 0.96 ENPP1 (0.37) PRF1ENPP1PDK2PTGDR2PTPN5
SCHEMBL22761212 0.94 PDK2 (0.41) PRF1ENPP1PDK2PTGDR2PTPN5
SCHEMBL22761149 0.94 PDK2 (0.39) PRF1ENPP1PDK2PTGDR2PTPN5
SCHEMBL22760862 0.92 PTGDR2 (0.41) PRF1ENPP1PDK2PTGDR2PTPN5
SCHEMBL22761192 0.92 PDK2 (0.39) PRF1ENPP1PDK2PTGDR2PTPN5
SCHEMBL22761240 0.92 PRF1 (0.36) PRF1ENPP1PDK2PTGDR2PTPN5
SCHEMBL21547171 0.91 PRF1 (0.35) PRF1ENPP1PDK2PTGDR2PTPN5
SCHEMBL21546522 0.91 PDK2 (0.41) PRF1ENPP1PDK2PTGDR2PTPN5
SCHEMBL21547041 0.91 ENPP1 (0.38) PRF1ENPP1PDK2PTGDR2PTPN5
SCHEMBL22761213 0.91 PDK2 (0.40) PRF1ENPP1PDK2PTGDR2PTPN5

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-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
EP-3478793-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-11-06 — — EP 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 PRF1 4364/4885ENPP1 2388/4885PDK2 2517/4885
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, EPCAM PRF1 4364/4885ENPP1 2388/4885PDK2 2517/4885

“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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