SCHEMBL25660959

SCHEMBL25660959

N#Cc1cc(C#N)cc(-c2ccc3c4ccccc4n(-c4cc(C#N)c(-c5ccc(C(F)(F)F)cc5C#N)cc4-n4c5ccccc5c5ccc(-c6cc(C#N)cc(C#N)c6)cc54)c3c2)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.36
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
RXRA P19793 1/20 0.33
RXRG P48443 1/20 0.33
PTPN5 P54829 1/20 0.32
SCN9A Q15858 1/20 0.32
PGR P06401 1/20 0.32
PDPK1 O15530 1/20 0.32
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
DGAT1 O75907 1/20 0.31
SOAT1 P35610 1/20 0.31
KCNH2 Q12809 1/20 0.31
PDK2 Q15119 1/20 0.31
XDH P47989 2/20 0.31
AR P10275 1/20 0.31
TRPA1 O75762 1/20 0.30
MAT2A P31153 1/20 0.30
TSHR P16473 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
SCHEMBL25659741 0.95 KIF11 (0.36) KIF11ALOX5APFEN1RXRARXRG
SCHEMBL25660958 0.95 ALOX5AP (0.39) KIF11ALOX5APFEN1RXRARXRG
SCHEMBL20112011 0.93 TRPA1 (0.35) KIF11ALOX5APFEN1RXRARXRG
SCHEMBL25660929 0.93 KIF11 (0.41) KIF11ALOX5APFEN1PTPN5SCN9A
SCHEMBL25659753 0.90 ALOX5AP (0.36) KIF11ALOX5APFEN1RXRARXRG
SCHEMBL20617117 0.90 RXRA (0.39) KIF11RXRARXRGPTPN5PGR
SCHEMBL19903696 0.89 RXRA (0.38) KIF11RXRARXRGPTPN5PGR
SCHEMBL25659720 0.89 PTPN5 (0.40) KIF11ALOX5APFEN1PTPN5GRIN1
SCHEMBL22822682 0.88 RXRA (0.39) KIF11RXRARXRGPTPN5PGR
SCHEMBL20112006 0.88 ALOX5AP (0.35) KIF11ALOX5APFEN1RXRARXRG

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-11825743-B2 Organic molecules for use in organic optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-11-21 US disclosed
EP-3585777-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO LTD (KR) 2023-05-10 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 (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-11825743-B2 Organic molecules for use in organic optoelectronic devices OR10J3, OR51E2, OCIAD2 KIF11 3288/4885ALOX5AP 3126/4885FEN1 1566/4885

“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.