SCHEMBL22760811

SCHEMBL22760811

N#Cc1cccc(-c2cc(-n3c4ccccc4c4ccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)cc43)c(-n3c4ccccc4c4ccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)cc43)cc2C#N)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
PTPN5 P54829 1/20 0.36
ENPP1 P22413 1/20 0.36
CETP P11597 1/20 0.35
PDK2 Q15119 1/20 0.35
MAT2A P31153 1/20 0.35
XDH P47989 1/20 0.34
KIF11 P52732 1/20 0.34
SCN9A Q15858 2/20 0.34
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
TRPA1 O75762 1/20 0.34
CYP2C9 P11712 1/20 0.34
RORC P51449 1/20 0.34
PGR P06401 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2B Q13224 1/20 0.33
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33

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
SCHEMBL22761038 0.96 PTGDR2 (0.39) ARPTGDR2PTPN5ENPP1CETP
SCHEMBL22761114 0.94 AR (0.37) ARPTGDR2PTPN5ENPP1CETP
SCHEMBL21258666 0.94 PTPN5 (0.39) ARPTGDR2PTPN5ENPP1CETP
SCHEMBL21546652 0.94 AR (0.37) ARPTGDR2PTPN5ENPP1CETP
SCHEMBL22822581 0.93 AR (0.37) ARCETPMAT2AXDHKIF11
SCHEMBL25659514 0.92 AR (0.38) ARXDHKIF11SCN9AALOX5AP
SCHEMBL22760624 0.92 PTGDR2 (0.38) ARPTGDR2PTPN5ENPP1CETP
SCHEMBL21546606 0.92 KIF11 (0.41) PTGDR2PTPN5ENPP1CETPPDK2
SCHEMBL20111883 0.91 PTPN5 (0.39) ARPTGDR2PTPN5ENPP1CETP
SCHEMBL22761051 0.91 PTGDR2 (0.39) ARPTGDR2PTPN5ENPP1CETP

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 AR 4523/4885PTGDR2 379/4885PTPN5 4550/4885
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, EPCAM AR 4523/4885PTGDR2 379/4885PTPN5 4550/4885

“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.