SCHEMBL20617249

SCHEMBL20617249

N#Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cc(C#N)cc(-n3c4ccccc4c4cc(-c5ccc(C#N)cc5)ccc43)c2-c2cc(C#N)cc(C(F)(F)F)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.42
RXRA P19793 1/20 0.41
RXRG P48443 1/20 0.41
PTPN5 P54829 2/20 0.35
TACR1 P25103 2/20 0.35
PDK2 Q15119 1/20 0.34
PTGER4 P35408 1/20 0.34
PDPK1 O15530 1/20 0.34
DGAT1 O75907 1/20 0.33
SOAT1 P35610 1/20 0.33
KCNH2 Q12809 1/20 0.33
XDH P47989 1/20 0.33
RORC P51449 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
SCHEMBL19917974 0.98 KIF11 (0.42) KIF11RXRARXRGPTPN5TACR1
SCHEMBL22564347 0.96 RXRA (0.43) KIF11RXRARXRGPTPN5TACR1
SCHEMBL20617427 0.94 RXRA (0.41) KIF11RXRARXRGPTPN5TACR1
SCHEMBL20617417 0.94 RXRA (0.41) KIF11RXRARXRGPTPN5TACR1
SCHEMBL20617411 0.94 KIF11 (0.47) KIF11RXRARXRGPTPN5TACR1
SCHEMBL20617171 0.94 RXRA (0.39) KIF11RXRARXRGPTPN5TACR1
SCHEMBL20617256 0.94 KIF11 (0.42) KIF11RXRARXRGPTPN5TACR1
SCHEMBL21414125 0.94 RXRA (0.41) KIF11RXRARXRGPTPN5TACR1
SCHEMBL19903668 0.94 RXRA (0.41) KIF11RXRARXRGPTPN5TACR1
SCHEMBL19903472 0.94 RXRA (0.41) KIF11RXRARXRGPTPN5TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11021473-B2 Organic molecules for use in organic optoelectronic devices CYNORA GMBH (DE) 2021-06-01 US disclosed
US-20200399256-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-24 US disclosed
EP-3642302-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-10-21 EP disclosed
WO-2019001838-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-01-03 WO 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-11021473-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, OCIAD2 KIF11 2841/4885RXRA 3552/4885RXRG 3138/4885
US-20200399256-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 KIF11 4320/4885RXRA 3876/4885RXRG 3543/4885

“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.